SCHEMBL6935964

SCHEMBL6935964

CC1CN(C(c2ccc(S(=O)(=O)N(C)C)cc2)c2cccc(O[Si](C)(C)C(C)(C)C)c2)C(C)CN1

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 6/20 0.35
OPRM1 P35372 5/20 0.35
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34

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
SCHEMBL6935966 1.00 OPRD1 (0.35) OPRD1OPRM1CYP1A2CYP3A4
SCHEMBL6939883 0.85 OPRD1 (0.35) OPRD1OPRM1CYP1A2CYP3A4
SCHEMBL4575843 0.85 OPRD1 (0.35) OPRD1OPRM1CYP1A2CYP3A4
SCHEMBL6939887 0.85 OPRD1 (0.35) OPRD1OPRM1CYP1A2CYP3A4
SCHEMBL7973592 0.85 OPRD1 (0.35) OPRD1OPRM1CYP1A2CYP3A4
SCHEMBL6939892 0.85 OPRD1 (0.35) OPRD1OPRM1CYP1A2CYP3A4
SCHEMBL2751545 0.83 OPRD1 (0.43) OPRD1OPRM1
SCHEMBL6928895 0.82 OPRD1 (0.33) OPRD1OPRM1CYP1A2CYP3A4
SCHEMBL5145212 0.82 OPRD1 (0.57) OPRD1OPRM1CYP1A2CYP3A4
SCHEMBL4577590 0.82 OPRD1 (0.57) OPRD1OPRM1CYP1A2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0649414-B1 OPIOID DIARYLMETHYLPIPERAZINES AND PIPERIDINES ARDENT PHARMACEUTICALS INC (US) 2003-04-16 EP disclosed
US-5854249-A Opioid diarylmethylpiperazines and piperidines DELTA PHARMACEUTICALS, INC. (US) 1998-12-29 US disclosed
US-5658908-A RECEPTOR BINDING SPECIES FOR MEDIATING ANALGESIA, COMBATTING DRUG ADDICTION, DRUG OVERDOSE DELTA PHARMACEUTICALS, INC. (US) 1997-08-19 US disclosed
EP-0649414-A1 OPIOID DIARYLMETHYLPIPERAZINES AND PIPERIDINES THE WELLCOME FOUNDATION LIMITED (GB) 1995-04-26 EP disclosed
WO-1993015062-A1 OPIOID DIARYLMETHYLPIPERAZINES AND PIPERIDINES THE WELLCOME FOUNDATION LIMITED (GB) 1993-08-05 WO disclosed