SCHEMBL5494845

SCHEMBL5494845

CC/C(C=O)=C\c1ccc2c(c1)OCCO2

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.49
KDM4E B2RXH2 2/20 0.48
ALDH1A1 P00352 5/20 0.47
HPGD P15428 4/20 0.47
POLB P06746 2/20 0.46
GAA P10253 1/20 0.46
DYRK1A Q13627 1/20 0.46
DYRK2 Q92630 1/20 0.46
DYRK1B Q9Y463 1/20 0.46
HTT P42858 1/20 0.45
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
TRPV1 Q8NER1 2/20 0.44
HSD17B10 Q99714 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
MAPK1 P28482 1/20 0.43
RAB9A P51151 3/20 0.43
MAPT P10636 3/20 0.43

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
SCHEMBL5494847 1.00 ATM (0.49) ATMKDM4EALDH1A1HPGDPOLB
SCHEMBL5497313 0.91 ALDH1A1 (0.56) ATMKDM4EALDH1A1DYRK1ADYRK2
SCHEMBL5497310 0.91 ALDH1A1 (0.56) ATMKDM4EALDH1A1DYRK1ADYRK2
SCHEMBL5496889 0.83 KDM4E (0.61) ATMKDM4EALDH1A1HPGDPOLB
SCHEMBL5496886 0.83 KDM4E (0.61) ATMKDM4EALDH1A1HPGDPOLB
SCHEMBL12499740 0.81 TRPV1 (0.54) ATMKDM4EALDH1A1HPGDPOLB
SCHEMBL12499733 0.81 TRPV1 (0.54) ATMKDM4EALDH1A1HPGDPOLB
SCHEMBL5495725 0.79 ALDH1A1 (0.53) ATMKDM4EALDH1A1HPGDCYP1A2
SCHEMBL9664652 0.79 ALDH1A1 (0.53) ATMKDM4EALDH1A1HPGDCYP1A2
SCHEMBL5495723 0.79 ALDH1A1 (0.53) ATMKDM4EALDH1A1HPGDCYP1A2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9073860-B2 Aromatic amides as potentiators of bioefficacy of anti-infective drugs COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2015-07-07 US disclosed
US-20140073595-A1 AROMATIC AMIDES AS POTENTIATORS OF BIOEFFICACY OF ANTI-INFECTIVE DRUGS COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2014-03-13 US disclosed
US-8580752-B2 Aromatic amides as potentiators of bioefficacy of anti-infective drugs COUNCIL OF SCIENTITIC AND INDUSTRIAL RESEARCH (IN) 2013-11-12 US disclosed
US-20070004645-A1 Aromatic amides as potentiators of bioefficacy of anti-infective drugs COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2007-01-04 US 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 (2 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-20140073595-A1 AROMATIC AMIDES AS POTENTIATORS OF BIOEFFICACY OF ANTI-INFECTIVE DRUGS DDC, APEH, AADAC ATM 4664/4885KDM4E 1523/4885ALDH1A1 265/4885
US-20070004645-A1 Aromatic amides as potentiators of bioefficacy of anti-infective drugs DDC, APEH, AADAC ATM 4664/4885KDM4E 1523/4885ALDH1A1 265/4885

“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.