SCHEMBL5164424

SCHEMBL5164424

CC(C)=CCC/C(C)=C/CON=O

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 3/20 0.59
ALDH1A1 P00352 3/20 0.59
KMT2A Q03164 3/20 0.54
FNTA P49354 5/20 0.51
FNTB P49356 3/20 0.51
MEN1 O00255 2/20 0.50
CYP3A4 P08684 2/20 0.50
PGGT1B P53609 2/20 0.49
KDM4E B2RXH2 2/20 0.48
MAPT P10636 2/20 0.48
UGT1A1 P22309 1/20 0.48
GGPS1 O95749 1/20 0.47
SQLE Q14534 1/20 0.47
ATM Q13315 1/20 0.46

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
SCHEMBL5164575 1.00 ALOX15 (0.59) ALOX15ALDH1A1KMT2AFNTAFNTB
SCHEMBL17154404 0.83
SCHEMBL23530356 0.79 KMT2A (0.62) ALOX15ALDH1A1KMT2AFNTAFNTB
SCHEMBL27228128 0.78 ALOX15 (0.66) ALOX15ALDH1A1KMT2AFNTAFNTB
SCHEMBL3400313 0.77 KMT2A (0.65) ALOX15ALDH1A1KMT2AFNTAFNTB
SCHEMBL28854298 0.77 KMT2A (0.65) ALOX15ALDH1A1KMT2AFNTAFNTB
SCHEMBL27649625 0.77 KMT2A (0.65) ALOX15ALDH1A1KMT2AFNTAFNTB
SCHEMBL10385940 0.77 KMT2A (0.65) ALOX15ALDH1A1KMT2AFNTAFNTB
SCHEMBL10385938 0.77 KMT2A (0.65) ALOX15ALDH1A1KMT2AFNTAFNTB
SCHEMBL492962 0.77 KMT2A (0.65) ALOX15ALDH1A1KMT2AFNTAFNTB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4096618-B1 A MIXTURE COMPRISING 1,2-ALKANEDIOLS SYMRISE AG (DE) 2025-01-29 EP claimed
EP-4438065-A2 A MIXTURE COMPRISING 1,2-ALKANEDIOLS Symrise AG (DE) 2024-10-02 EP claimed
EP-4096618-A1 A MIXTURE COMPRISING 1,2-ALKANEDIOLS Symrise AG (DE) 2022-12-07 EP claimed
US-20220364016-A1 PERFUME OIL MIXTURE SYMRISE AG (DE) 2022-11-17 US claimed
WO-2022122143-A1 A MIXTURE COMPRISING 1,2-ALKANEDIOLS SYMRISE AG (DE) 2022-06-16 WO claimed
US-20260098021-A1 Nitrosation Reagents and Methods UNIV CALIFORNIA (US) 2026-04-09 US disclosed
US-12459909-B2 Nitrosation reagents and methods THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2025-11-04 US disclosed
US-12421474-B2 Perfume oil mixture SYMRISE AG (DE) 2025-09-23 US disclosed
EP-4096618-B1 A MIXTURE COMPRISING 1,2-ALKANEDIOLS SYMRISE AG (DE) 2025-01-29 EP disclosed
EP-4438065-A2 A MIXTURE COMPRISING 1,2-ALKANEDIOLS Symrise AG (DE) 2024-10-02 EP disclosed
US-20230242495-A1 Nitrosation Reagents and Methods THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2023-08-03 US disclosed
US-20230242495-A1 Nitrosation Reagents and Methods THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2023-08-03 US disclosed
US-6342612-B1 FRAGRANCES INTERNATIONAL FLAVORS & FRAGRANCES INC. 2002-01-29 US disclosed
EP-1149149-A1 DETERGENT COMPOSITION QUEST INTERNATIONAL B.V. (NL) 2001-10-31 EP disclosed
EP-1027317-A1 REACTION OF ALKENES WITH EPOXIDES, THE PRODUCTS THEREOF AND THEIR USE AS FRAGRANCE COMPOUNDS QUEST INTERNATIONAL B.V. (NL) 2000-08-16 EP disclosed
WO-2000046337-A1 DETERGENT COMPOSITION QUEST INTERNATIONAL B.V. (NL) 2000-08-10 WO disclosed
EP-1001013-A1 Process of cleaning enamel surfaces THE PROCTER & GAMBLE COMPANY (US) 2000-05-17 EP disclosed
EP-0982394-A1 Liquid neutral or alkaline hard-surface cleaning composition THE PROCTER & GAMBLE COMPANY (US) 2000-03-01 EP disclosed
WO-1999024386-A1 PRINS REACTION PRODUCTS OF 5,7-DIMETHYL-OCT-6-EN-2-ONE AND THEIR USE AS FRAGRANCE MATERIALS QUEST INTERNATIONAL B.V. (NL) 1999-05-20 WO disclosed
WO-1999021817-A1 REACTION OF ALKENES WITH EPOXIDES, THE PRODUCTS THEREOF AND THEIR USE AS FRAGRANCE COMPOUNDS QUEST INTERNATIONAL B.V. (NL) 1999-05-06 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 (3 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-12459909-B2 Nitrosation reagents and methods NOS2, NOS1, NNMT ALOX15 596/4885ALDH1A1 535/4885KMT2A 3043/4885
US-20260098021-A1 Nitrosation Reagents and Methods TXN, CBR1, CBR3 ALOX15 785/4885ALDH1A1 716/4885KMT2A 1866/4885
US-20230242495-A1 Nitrosation Reagents and Methods NOS2, NOS1, NNMT ALOX15 596/4885ALDH1A1 535/4885KMT2A 3043/4885

“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.