SCHEMBL2832986

SCHEMBL2832986

C/C(C=O)=C\C=C\C(C)=C\C=C\C(C)=C\C=C\C=C(C)\C=C\C=C(C)\C=C\C=C(/C)C=O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.58
ALOX15 P16050 4/20 0.58
TSHR P16473 4/20 0.58
TDP1 Q9NUW8 3/20 0.58
RECQL P46063 2/20 0.58
HSD17B10 Q99714 2/20 0.58
PTGS1 P23219 2/20 0.56
MAPT P10636 4/20 0.45
KDM4E B2RXH2 1/20 0.45
LMNA P02545 3/20 0.43
NR1I2 O75469 1/20 0.43
PGR P06401 1/20 0.43
DRD3 P35462 1/20 0.34
SLCO1B3 Q9NPD5 1/20 0.34
SLCO1B1 Q9Y6L6 1/20 0.34
CYP3A4 P08684 2/20 0.34
TRPV1 Q8NER1 1/20 0.34
HIF1A Q16665 1/20 0.34
TP53 P04637 1/20 0.34
APP P05067 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5074195 1.00 ALDH1A1 (0.58) ALDH1A1ALOX15TSHRTDP1RECQL
SCHEMBL2616645 1.00 ALDH1A1 (0.58) ALDH1A1ALOX15TSHRTDP1RECQL
SCHEMBL17366592 1.00 ALDH1A1 (0.58) ALDH1A1ALOX15TSHRTDP1RECQL
SCHEMBL13903784 1.00 ALDH1A1 (0.58) ALDH1A1ALOX15TSHRTDP1RECQL
Methyl Alcohol SCHEMBL28459263 0.97 ALDH1A1 (0.56) ALDH1A1ALOX15TSHRTDP1RECQL
SCHEMBL13903775 0.93 ALDH1A1 (0.52) ALDH1A1ALOX15TSHRTDP1RECQL
SCHEMBL4124093 0.93 ALDH1A1 (0.52) ALDH1A1ALOX15TSHRTDP1RECQL
SCHEMBL21382193 0.93 ALDH1A1 (0.52) ALDH1A1ALOX15TSHRTDP1RECQL
SCHEMBL13903782 0.93 ALDH1A1 (0.52) ALDH1A1ALOX15TSHRTDP1RECQL
SCHEMBL4124094 0.93 ALDH1A1 (0.52) ALDH1A1ALOX15TSHRTDP1RECQL

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 56 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4444898-A1 PREDICTION, BIOSYNTHESIS, AND INTEGRATION AS BIOSENSORS OF MOLECULES WITH UNIQUE LIGHT ABSORBANCE SIGNATURES AND THEIR SUBSEQUENT IN-FIELD REMOTE DETECTION USING MULTI OR HYPER-SPECTRAL CAMERAS Massachusetts Institute of Technology (US) 2024-10-16 EP claimed
US-20230183677-A1 PREDICTION, BIOSYNTHESIS, AND INTEGRATION AS BIOSENSORS OF MOLECULES WITH UNIQUE LIGHT ABSORBANCE SIGNATURES AND THEIR SUBSEQUENT IN-FIELD REMOTE DETECTION USING MULTI OR HYPER-SPECTRAL CAMERAS MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2023-06-15 US claimed
WO-2023107188-A1 PREDICTION, BIOSYNTHESIS, AND INTEGRATION AS BIOSENSORS OF MOLECULES WITH UNIQUE LIGHT ABSORBANCE SIGNATURES AND THEIR SUBSEQUENT IN-FIELD REMOTE DETECTION USING MULTI OR HYPER-SPECTRAL CAMERAS MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2023-06-15 WO claimed
US-20240423911-A1 EMULSION COMPOSITION ASTAREAL CO., LTD. (JP) 2024-12-26 US disclosed
EP-4444898-A1 PREDICTION, BIOSYNTHESIS, AND INTEGRATION AS BIOSENSORS OF MOLECULES WITH UNIQUE LIGHT ABSORBANCE SIGNATURES AND THEIR SUBSEQUENT IN-FIELD REMOTE DETECTION USING MULTI OR HYPER-SPECTRAL CAMERAS Massachusetts Institute of Technology (US) 2024-10-16 EP disclosed
WO-2023107188-A1 PREDICTION, BIOSYNTHESIS, AND INTEGRATION AS BIOSENSORS OF MOLECULES WITH UNIQUE LIGHT ABSORBANCE SIGNATURES AND THEIR SUBSEQUENT IN-FIELD REMOTE DETECTION USING MULTI OR HYPER-SPECTRAL CAMERAS MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2023-06-15 WO disclosed
US-20230183677-A1 PREDICTION, BIOSYNTHESIS, AND INTEGRATION AS BIOSENSORS OF MOLECULES WITH UNIQUE LIGHT ABSORBANCE SIGNATURES AND THEIR SUBSEQUENT IN-FIELD REMOTE DETECTION USING MULTI OR HYPER-SPECTRAL CAMERAS MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2023-06-15 US disclosed
EP-1866323-B1 GLUCURONIDATED NEBIVOLOL MYLAN LAB INC (US) 2017-05-31 EP disclosed
EP-1848424-B1 PHARMACEUTICAL COMPOSITION COMPRISING HYDROXYLATED NEBIVOLOL MYLAN LAB INC (US) 2017-04-05 EP disclosed
US-9365561-B2 C5 benzothiazolyl sulfone compound, method of preparing preparing the same, method of preparing polyene dialdehyde compound using the same, and method of synthesizing lycopene using the same MYONGJI UNIVERSITY INDUSTRY AND ACADEMIA COOPERATION FOUNDATION (KR) 2016-06-14 US disclosed
US-9365561-B2 C5 benzothiazolyl sulfone compound, method of preparing preparing the same, method of preparing polyene dialdehyde compound using the same, and method of synthesizing lycopene using the same MYONGJI UNIVERSITY INDUSTRY AND ACADEMIA COOPERATION FOUNDATION (KR) 2016-06-14 US disclosed
US-20050059635-A1 Carotenoid ester analogs or derivatives for controlling C-reactive protein levels CARDAX PHARMACEUTICALS, INC. 2005-03-17 US disclosed
US-20050049248-A1 Carotenoid ether analogs or derivatives for controlling C-reactive protein levels CARDAX PHARMACEUTICALS, INC. 2005-03-03 US disclosed
US-20050037995-A1 Carotenoid ester analogs or derivatives for the inhibition and amelioration of ischemic reperfusion injury CARDAX PHARMA, INC. 2005-02-17 US disclosed
US-20050026874-A1 Carotenoid ether analogs or derivatives for the inhibition and amelioration of liver disease CARDAX PHARMACEUTICALS, INC. 2005-02-03 US disclosed
US-20050009930-A1 Carotenoid analogs or derivatives for controlling connexin 43 expression CARDAX PHARMA, INC. 2005-01-13 US disclosed
US-20050009788-A1 Carotenoid ester analogs or derivatives for controlling connexin 43 expression CARDAX PHARMACEUTICALS, INC. 2005-01-13 US disclosed
US-20050009758-A1 Carotenoid ether analogs or derivatives for the inhibition and amelioration of disease CARDAX PHARMA, INC. 2005-01-13 US disclosed
US-20050004235-A1 Carotenoid analogs or derivatives for the inhibition and amelioration of liver disease CARDAX PHARMACEUTICALS, INC. 2005-01-06 US disclosed
WO-2004101746-A2 PRODUCTION OF CAROTENOIDS IN MICROORGANISMS REGENTS FOR THE UNIVERSITY OF MINNESOTA (US) 2004-11-25 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (8 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050037995-A1 Carotenoid ester analogs or derivatives for the inhibition and amelioration of ischemic reperfusion injury CPT1A, TXNRD2, PC ALDH1A1 850/4885ALOX15 29/4885TSHR 3827/4885
US-20050009788-A1 Carotenoid ester analogs or derivatives for controlling connexin 43 expression GJA1, GJB2, CRY1 ALDH1A1 1497/4885ALOX15 194/4885TSHR 4469/4885
US-20050009930-A1 Carotenoid analogs or derivatives for controlling connexin 43 expression GJA1, GJB2, CRY1 ALDH1A1 1114/4885ALOX15 250/4885TSHR 4220/4885
US-20050059635-A1 Carotenoid ester analogs or derivatives for controlling C-reactive protein levels TTPA, PROC, RBP4 ALDH1A1 3143/4885ALOX15 38/4885TSHR 2941/4885
US-20050026874-A1 Carotenoid ether analogs or derivatives for the inhibition and amelioration of liver disease GYS2, HCCS, CPT1A ALDH1A1 1354/4885ALOX15 86/4885TSHR 2664/4885
US-20050049248-A1 Carotenoid ether analogs or derivatives for controlling C-reactive protein levels PROC, TTPA, CYC1 ALDH1A1 3798/4885ALOX15 116/4885TSHR 2794/4885
US-20050009758-A1 Carotenoid ether analogs or derivatives for the inhibition and amelioration of disease NFE2L2, GPX4, CYP11B2 ALDH1A1 2470/4885ALOX15 18/4885TSHR 3520/4885
US-20050004235-A1 Carotenoid analogs or derivatives for the inhibition and amelioration of liver disease GYS2, HCCS, CPT1A ALDH1A1 557/4885ALOX15 51/4885TSHR 3061/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.