SCHEMBL5435355

SCHEMBL5435355

CCN(CC)C(=O)c1ccc(C(=C2CCNCC2)c2ccccc2Oc2ccccc2)cc1

nearest known ligand 0.78

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 18/20 0.78
OPRM1 P35372 16/20 0.78
OPRK1 P41145 6/20 0.69
KCNH2 Q12809 2/20 0.58
ABCB11 O95342 1/20 0.55
LMNA P02545 1/20 0.51
MAPT P10636 1/20 0.51

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
SCHEMBL5434131 0.93 OPRD1 (0.77) OPRD1OPRM1OPRK1KCNH2ABCB11
SCHEMBL5435556 0.93 OPRD1 (0.74) OPRD1OPRM1OPRK1KCNH2ABCB11
SCHEMBL4929198 0.88 OPRD1 (1.00) OPRD1OPRM1OPRK1KCNH2ABCB11
SCHEMBL5427821 0.85 OPRD1 (0.76) OPRD1OPRM1OPRK1KCNH2ABCB11
SCHEMBL5435473 0.84 OPRD1 (0.73) OPRD1OPRM1OPRK1KCNH2ABCB11
SCHEMBL5463355 0.83 OPRD1 (0.80) OPRD1OPRM1OPRK1KCNH2ABCB11
SCHEMBL4924161 0.83 OPRD1 (1.00) OPRD1OPRM1OPRK1KCNH2ABCB11
SCHEMBL5435685 0.82 OPRD1 (0.74) OPRD1OPRM1OPRK1KCNH2ABCB11
SCHEMBL5432256 0.82 OPRD1 (0.73) OPRD1OPRM1OPRK1KCNH2ABCB11
Hydrochloric Acid SCHEMBL29874927 0.81 OPRD1 (0.97) OPRD1OPRM1OPRK1KCNH2ABCB11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070066652-A1 Diarylmethylidene piperidine derivatives, preparations thereof and uses thereof ASTRAZENECA AB (SE) 2007-03-22 US claimed
US-20060287361-A1 Diarylmethylidene piperidine derivatives, preparations thereof and uses thereof as opoid receptors ligands ASTRAZENECA AB (SE) 2006-12-21 US claimed
EP-1638564-A1 DIARYLMETHYLIDENE PIPERIDINE DERIVATIVES, PREPARATIONS THEREOF AND USES THEREOF AS OPIOID RECEPTORS LIGANDS AstraZeneca AB (SE) 2006-03-29 EP claimed
EP-1626959-A1 DIARYLMETHYLIDENE PIPERIDINE DERIVATIVES, PREPARATIONS THEREOF AND USES THEREOF AstraZeneca AB (SE) 2006-02-22 EP claimed
WO-2004100952-A1 DIARYLMETHYLIDENE PIPERIDINE DERIVATIVES, PREPARATIONS THEREOF AND USES THEREOF AS OPIOID RECEPTORS LIGANDS ASTRAZENECA AB (SE) 2004-11-25 WO claimed
WO-2004101519-A1 DIARYLMETHYLIDENE PIPERIDINE DERIVATIVES, PREPARATIONS THEREOF AND USES THEREOF ASTRAZENECA AB (SE) 2004-11-25 WO claimed
US-20070066652-A1 Diarylmethylidene piperidine derivatives, preparations thereof and uses thereof ASTRAZENECA AB (SE) 2007-03-22 US disclosed
US-20070066652-A1 Diarylmethylidene piperidine derivatives, preparations thereof and uses thereof ASTRAZENECA AB (SE) 2007-03-22 US disclosed
US-20070066652-A1 Diarylmethylidene piperidine derivatives, preparations thereof and uses thereof ASTRAZENECA AB (SE) 2007-03-22 US disclosed
US-20060287361-A1 Diarylmethylidene piperidine derivatives, preparations thereof and uses thereof as opoid receptors ligands ASTRAZENECA AB (SE) 2006-12-21 US disclosed
EP-1638564-A1 DIARYLMETHYLIDENE PIPERIDINE DERIVATIVES, PREPARATIONS THEREOF AND USES THEREOF AS OPIOID RECEPTORS LIGANDS AstraZeneca AB (SE) 2006-03-29 EP disclosed
EP-1626959-A1 DIARYLMETHYLIDENE PIPERIDINE DERIVATIVES, PREPARATIONS THEREOF AND USES THEREOF AstraZeneca AB (SE) 2006-02-22 EP disclosed
WO-2004101519-A1 DIARYLMETHYLIDENE PIPERIDINE DERIVATIVES, PREPARATIONS THEREOF AND USES THEREOF ASTRAZENECA AB (SE) 2004-11-25 WO disclosed
WO-2004100952-A1 DIARYLMETHYLIDENE PIPERIDINE DERIVATIVES, PREPARATIONS THEREOF AND USES THEREOF AS OPIOID RECEPTORS LIGANDS ASTRAZENECA AB (SE) 2004-11-25 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 (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-20070066652-A1 Diarylmethylidene piperidine derivatives, preparations thereof and uses thereof OPRM1, OPRD1, OPRL1 OPRD1 2/4885OPRM1 1/4885OPRK1 4/4885
US-20060287361-A1 Diarylmethylidene piperidine derivatives, preparations thereof and uses thereof as opoid receptors ligands OPRM1, OPRL1, OPRD1 OPRD1 3/4885OPRM1 1/4885OPRK1 4/4885

“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.