SCHEMBL3925645

SCHEMBL3925645

CC(C)(C)[C@H](NC(=O)n1c(=O)n(CC2CCCCC2)c2ccccc21)C(=O)NCCO

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 15/20 0.56
CNR1 P21554 6/20 0.56
OPRM1 P35372 1/20 0.40
OPRL1 P41146 1/20 0.40
TMEM97 Q5BJF2 1/20 0.39
SIGMAR1 Q99720 1/20 0.39
HTR3A P46098 1/20 0.39
HTR4 Q13639 1/20 0.39

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
SCHEMBL3916134 0.91 CNR2 (0.64) CNR2CNR1
SCHEMBL3917927 0.90 CNR2 (0.58) CNR2CNR1OPRM1OPRL1TMEM97
SCHEMBL3927661 0.90 CNR2 (0.54) CNR2CNR1OPRM1OPRL1TMEM97
SCHEMBL4384480 0.88 CNR2 (0.55) CNR2CNR1
SCHEMBL3915515 0.86 CNR2 (0.62) CNR2CNR1
SCHEMBL4382324 0.85 CNR2 (0.74) CNR2CNR1OPRM1OPRL1TMEM97
SCHEMBL4274319 0.84 CNR2 (0.51) CNR2CNR1
SCHEMBL3925539 0.84 CNR2 (0.57) CNR2CNR1TMEM97SIGMAR1HTR3A
SCHEMBL3916842 0.82 CNR2 (0.75) CNR2CNR1OPRL1TMEM97SIGMAR1
SCHEMBL3919334 0.82 CNR2 (0.62) CNR2CNR1OPRM1OPRL1TMEM97

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090298811-A1 BENZIMIDAZOLONE DERIVATIVES PFIZER INC 2009-12-03 US claimed
EP-2114897-A2 BENZIMIDAZOLONE DERIVATIVES Pfizer Products Inc. (US) 2009-11-11 EP claimed
WO-2008032164-A2 BENZIMIDAZOLONE DERIVATIVES PFIZER PRODUCTS INC. (US) 2008-03-20 WO claimed
US-20090298811-A1 BENZIMIDAZOLONE DERIVATIVES PFIZER INC 2009-12-03 US disclosed
EP-2114897-A2 BENZIMIDAZOLONE DERIVATIVES Pfizer Products Inc. (US) 2009-11-11 EP disclosed
WO-2008032164-A2 BENZIMIDAZOLONE DERIVATIVES PFIZER PRODUCTS INC. (US) 2008-03-20 WO disclosed
WO-2008032164-A2 BENZIMIDAZOLONE DERIVATIVES PFIZER PRODUCTS INC. (US) 2008-03-20 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 (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 CNR2 3/4885CNR1 2/4885OPRM1 305/4885

“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.