SCHEMBL1602876

SCHEMBL1602876

CCN(CC)C(=O)c1ccc(C(=C2CCNCC2)c2ccccc2NC(=O)OC)cc1

nearest known ligand 0.70

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 19/20 0.70
OPRM1 P35372 17/20 0.70
KCNH2 Q12809 3/20 0.66
OPRK1 P41145 6/20 0.65
ABCB11 O95342 1/20 0.54

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
SCHEMBL1603412 0.89 OPRD1 (0.69) OPRD1OPRM1KCNH2OPRK1ABCB11
SCHEMBL1603433 0.88 OPRD1 (0.71) OPRD1OPRM1KCNH2OPRK1ABCB11
SCHEMBL1602056 0.86 OPRD1 (0.65) OPRD1OPRM1KCNH2OPRK1ABCB11
SCHEMBL1603934 0.85 OPRD1 (0.64) OPRD1OPRM1KCNH2OPRK1ABCB11
SCHEMBL1603960 0.84 OPRD1 (0.68) OPRD1OPRM1KCNH2OPRK1ABCB11
SCHEMBL1603316 0.84 OPRD1 (0.69) OPRD1OPRM1KCNH2OPRK1ABCB11
SCHEMBL1603275 0.84 OPRD1 (0.62) OPRD1OPRM1KCNH2OPRK1ABCB11
SCHEMBL4990029 0.84 OPRD1 (0.71) OPRD1OPRM1KCNH2OPRK1ABCB11
SCHEMBL1602447 0.83 OPRD1 (0.62) OPRD1OPRM1KCNH2OPRK1ABCB11
SCHEMBL1603325 0.83 OPRD1 (0.62) OPRD1OPRM1KCNH2OPRK1ABCB11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110082173-A1 DIARYLMETHYLIDENE PIPERIDINE DERIVATIVES, PREPARATIONS THEREOF AND USES THEREOF ASTRAZENECA AB (SE) 2011-04-07 US claimed
US-20070099957-A1 Diarylmethylidene piperidine derivatives, preparations thereof and uses thereof ASTRA ZENECA AB (SE) 2007-05-03 US claimed
EP-1641757-A1 DIARYLMETHYLIDENE PIPERIDINE DERIVATIVES, PREPARATIONS THEREOF AND USES THEREOF AstraZeneca AB (SE) 2006-04-05 EP claimed
WO-2004101522-A1 DIARYLMETHYLIDENE PIPERIDINE DERIVATIVES, PREPARATIONS THEREOF AND USES THEREOF ASTRAZENECA AB (SE) 2004-11-25 WO claimed
US-20110082173-A1 DIARYLMETHYLIDENE PIPERIDINE DERIVATIVES, PREPARATIONS THEREOF AND USES THEREOF ASTRAZENECA AB (SE) 2011-04-07 US disclosed
US-20070099957-A1 Diarylmethylidene piperidine derivatives, preparations thereof and uses thereof ASTRA ZENECA AB (SE) 2007-05-03 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 (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-20070099957-A1 Diarylmethylidene piperidine derivatives, preparations thereof and uses thereof OPRM1, OPRD1, QDPR OPRD1 2/4885OPRM1 1/4885KCNH2 72/4885
US-20110082173-A1 DIARYLMETHYLIDENE PIPERIDINE DERIVATIVES, PREPARATIONS THEREOF AND USES THEREOF OPRM1, OPRD1, QDPR OPRD1 2/4885OPRM1 1/4885KCNH2 72/4885

“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.