SCHEMBL493393

SCHEMBL493393

CN(C)C(c1cccc(F)c1)C1CCC(CNC(=O)CN)CC1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 6/20 0.44
HTR6 P50406 1/20 0.41
OPRM1 P35372 7/20 0.38
PTGIR P43119 1/20 0.38
OPRD1 P41143 1/20 0.38
OPRK1 P41145 1/20 0.38
DPP4 P27487 1/20 0.37
DPP9 Q86TI2 1/20 0.37
F10 P00742 1/20 0.36
PRSS1 P07477 1/20 0.36

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
SCHEMBL492705 0.93 OPRL1 (0.44) OPRL1OPRM1PTGIROPRD1OPRK1
SCHEMBL492704 0.92 OPRL1 (0.44) OPRL1OPRM1PTGIROPRD1OPRK1
SCHEMBL1327796 0.88 OPRL1 (0.43) OPRL1OPRM1PTGIROPRD1OPRK1
SCHEMBL493392 0.87 OPRL1 (0.44) OPRL1OPRM1PTGIROPRD1OPRK1
SCHEMBL2307382 0.87 CNR2 (0.50) OPRL1OPRM1PTGIROPRD1
SCHEMBL1327170 0.83 RAB9A (0.49) OPRL1
SCHEMBL1326793 0.83 OPRL1 (0.45) OPRL1OPRM1PTGIROPRD1OPRK1
SCHEMBL1326706 0.82 HTR7 (0.42) OPRL1OPRM1PTGIR
SCHEMBL2310616 0.82 CACNA1I (0.48) OPRL1OPRM1
SCHEMBL493073 0.81 AOC3 (0.41) OPRL1OPRM1OPRD1OPRK1

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
US-20080306084-A1 Substituted Amide Compounds GRUENENTHAL GMBH (DE) 2008-12-11 US claimed
US-8106055-B2 Substituted amide compounds GRUENENTHAL GMBH (DE) 2012-01-31 US disclosed
US-20080306084-A1 Substituted Amide Compounds GRUENENTHAL GMBH (DE) 2008-12-11 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-20080306084-A1 Substituted Amide Compounds OPRK1, NAA50, ACMSD OPRL1 4/4885HTR6 2114/4885OPRM1 20/4885

“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.