SCHEMBL6980543

SCHEMBL6980543

Cc1ccc(CC(=O)N(O)C(CN2CCC(O)C2)c2ccccc2)cc1C

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 15/20 0.56
OPRM1 P35372 11/20 0.56
OPRD1 P41143 11/20 0.56
CYP2D6 P10635 8/20 0.56

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
SCHEMBL6980548 1.00 OPRK1 (0.56) OPRK1OPRM1OPRD1CYP2D6
SCHEMBL6979508 0.86 OPRK1 (0.61) OPRK1OPRM1OPRD1CYP2D6
SCHEMBL6983978 0.86 OPRK1 (0.61) OPRK1OPRM1OPRD1CYP2D6
SCHEMBL6979451 0.86 CCR5 (0.58) OPRK1OPRM1OPRD1CYP2D6
SCHEMBL6973676 0.86 OPRK1 (0.61) OPRK1OPRM1OPRD1CYP2D6
SCHEMBL6981228 0.86 OPRK1 (0.61) OPRK1OPRM1OPRD1CYP2D6
SCHEMBL6973674 0.86 OPRK1 (0.61) OPRK1OPRM1OPRD1CYP2D6
SCHEMBL6979455 0.86 CCR5 (0.58) OPRK1OPRM1OPRD1CYP2D6
SCHEMBL6978143 0.86 OPRK1 (0.62) OPRK1OPRM1OPRD1CYP2D6
SCHEMBL6978148 0.86 OPRK1 (0.62) OPRK1OPRM1OPRD1CYP2D6

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-0817772-B1 PYRROLIDINYL HYDROXAMIC ACID COMPOUNDS AND THEIR PRODUCTION PROCESS PFIZER (US) 2003-01-29 EP claimed
EP-0817772-B1 PYRROLIDINYL HYDROXAMIC ACID COMPOUNDS AND THEIR PRODUCTION PROCESS PFIZER (US) 2003-01-29 EP disclosed
US-6110947-A AN ANALGESIC AGENT FOR TREATING STROKE, ABDOMINAL PAIN; AS ANTIINFLAMMATORY, DIURETIC, ANESTHETIC OR NEUROPROTECTIVE AGENTS PFIZER INC. (US) 2000-08-29 US disclosed
EP-0817772-A1 PYRROLIDINYL HYDROXAMIC ACID COMPOUNDS AND THEIR PRODUCTION PROCESS PFIZER INC. (US) 1998-01-14 EP disclosed
WO-1996030339-A1 PYRROLIDINYL HYDROXAMIC ACID COMPOUNDS AND THEIR PRODUCTION PROCESS PFIZER INC. (US) 1996-10-03 WO disclosed