SCHEMBL735686

SCHEMBL735686

Cc1c(C2(O)CCC(c3ccccc3)(N(C)C)CC2)[nH]c2ccncc12

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 19/20 0.59
OPRL1 P41146 14/20 0.59
L3MBTL1 Q9Y468 1/20 0.52
OPRK1 P41145 5/20 0.50
OGFRL1 Q5TC84 6/20 0.46
OPRD1 P41143 2/20 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
SCHEMBL736247 0.81 OPRL1 (0.54) OPRM1OPRL1OPRK1OGFRL1OPRD1
SCHEMBL735020 0.77 OPRL1 (0.47) OPRM1OPRL1OPRK1OGFRL1
SCHEMBL13805852 0.76 OPRM1 (0.77) OPRM1OPRL1OPRK1OGFRL1OPRD1
SCHEMBL4115951 0.76 OPRM1 (0.76) OPRM1OPRL1OPRK1OGFRL1OPRD1
SCHEMBL3407442 0.75 OPRM1 (1.00) OPRM1OPRL1OPRK1OGFRL1OPRD1
SCHEMBL3411311 0.74 OPRM1 (0.74) OPRM1OPRL1OPRK1OGFRL1OPRD1
SCHEMBL13805915 0.74 OPRM1 (0.77) OPRM1OPRL1OPRK1OGFRL1OPRD1
SCHEMBL1119831 0.74 OPRM1 (0.86) OPRM1OPRL1OPRK1OGFRL1OPRD1
SCHEMBL1119806 0.73 OPRM1 (0.84) OPRM1OPRL1OPRK1OGFRL1OPRD1
SCHEMBL734668 0.73 OPRM1 (0.45) OPRM1OPRL1OPRK1OGFRL1OPRD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2044016-B1 4-HETEROARYL-SUBSTITUTED 1-AMINOCYCLOHEXANE-1-AND CYCLOHEXENE-1-DERIVATIVES HAVING EFFECTS ON THE OPIOD RECEPTOR SYSTEM GRUENENTHAL GMBH (DE) 2012-12-05 EP disclosed
US-8138187-B2 Substituted heteroaryl derivatives GRUENENTHAL GMBH (DE) 2012-03-20 US disclosed
US-20100009986-A1 SUBSTITUTED HETEROARYL DERIVATIVES GRUNENTHAL GMBH (DE) 2010-01-14 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-20100009986-A1 SUBSTITUTED HETEROARYL DERIVATIVES CYP3A43, HMGCR, ABCG2 OPRM1 1029/4885OPRL1 1562/4885L3MBTL1 3675/4885

“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.