SCHEMBL1603398

SCHEMBL1603398

CCN(CC)C(=O)c1ccc(C(=C2CCN(Cc3cccnc3)CC2)c2ccccc2NC(C)=O)cc1

nearest known ligand 0.63

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 17/20 0.63
OPRM1 P35372 15/20 0.63
KCNH2 Q12809 9/20 0.63
OPRK1 P41145 4/20 0.48
LMNA P02545 1/20 0.46
HPGD P15428 1/20 0.46
HTT P42858 1/20 0.46
SMN1; SMN2 Q16637 1/20 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
SCHEMBL5469067 0.93 OPRD1 (0.62) OPRD1OPRM1KCNH2OPRK1
SCHEMBL12708341 0.92 OPRD1 (0.75) OPRD1OPRM1KCNH2OPRK1
SCHEMBL1603178 0.91 OPRD1 (0.61) OPRD1OPRM1KCNH2OPRK1LMNA
SCHEMBL1603542 0.91 OPRD1 (0.69) OPRD1OPRM1KCNH2OPRK1
SCHEMBL1603538 0.90 OPRD1 (0.73) OPRD1OPRM1KCNH2OPRK1
SCHEMBL4999897 0.88 OPRD1 (0.71) OPRD1OPRM1KCNH2OPRK1HTT
SCHEMBL1603597 0.86 OPRD1 (0.64) OPRD1OPRM1KCNH2OPRK1LMNA
SCHEMBL1603346 0.84 OPRD1 (0.61) OPRD1OPRM1KCNH2OPRK1
SCHEMBL6110756 0.84 OPRD1 (0.75) OPRD1OPRM1KCNH2OPRK1
SCHEMBL1604190 0.84 OPRD1 (0.58) OPRD1OPRM1KCNH2OPRK1

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 8 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
US-20110082173-A1 DIARYLMETHYLIDENE PIPERIDINE DERIVATIVES, PREPARATIONS THEREOF AND USES THEREOF ASTRAZENECA AB (SE) 2011-04-07 US disclosed
US-20110082173-A1 DIARYLMETHYLIDENE PIPERIDINE DERIVATIVES, PREPARATIONS THEREOF AND USES THEREOF ASTRAZENECA AB (SE) 2011-04-07 US disclosed
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
US-20070099957-A1 Diarylmethylidene piperidine derivatives, preparations thereof and uses thereof ASTRA ZENECA AB (SE) 2007-05-03 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.