SCHEMBL4382175

SCHEMBL4382175

NC(=O)[C@@H](NC(=O)n1c(=O)n(Cc2cnccn2)c2ccccc21)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.43
GABRA5 P31644 1/20 0.43
CNR2 P34972 12/20 0.42
CNR1 P21554 5/20 0.41
OPRM1 P35372 2/20 0.37
OPRL1 P41146 1/20 0.36
GRIN1 Q05586 1/20 0.36
GRIN2B Q13224 1/20 0.36
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
PDGFRA P16234 1/20 0.35
MAPK1 P28482 1/20 0.35
MAPKAPK2 P49137 1/20 0.35
RPS6KA1 Q15418 1/20 0.35
AURKB Q96GD4 1/20 0.35
CSNK1G1 Q9HCP0 1/20 0.35
ROCK2 O75116 2/20 0.34
ROCK1 Q13464 2/20 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
SCHEMBL4382281 0.89 OPRM1 (0.45) GABRA1GABRA5CNR2CNR1OPRM1
SCHEMBL4385288 0.79 GABRA5 (0.44) GABRA1GABRA5CNR2CNR1OPRM1
SCHEMBL4378735 0.74 CNR2 (0.52) CNR2CNR1
SCHEMBL3918701 0.73 CNR2 (0.52) CNR2CNR1
SCHEMBL14261271 0.73 CNR2 (0.52) GABRA1GABRA5CNR2CNR1
SCHEMBL3918429 0.73 CNR2 (0.52) CNR2CNR1
SCHEMBL4387679 0.72 CNR2 (0.67) GABRA1GABRA5CNR2CNR1
SCHEMBL3915554 0.71 CNR2 (0.59) CNR2CNR1
SCHEMBL4384903 0.70 CNR2 (0.64) CNR2CNR1
SCHEMBL4377147 0.67 CNR2 (0.70) CNR2CNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090298811-A1 BENZIMIDAZOLONE DERIVATIVES PFIZER INC 2009-12-03 US claimed
US-20090298811-A1 BENZIMIDAZOLONE DERIVATIVES PFIZER INC 2009-12-03 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 (1 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-20090298811-A1 BENZIMIDAZOLONE DERIVATIVES TRPV1, CNR1, CNR2 GABRA1 77/4885GABRA5 80/4885CNR2 3/4885

“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.