SCHEMBL8938340

SCHEMBL8938340

NC(=O)c1cccc(CCN2CCCCC2OC(c2ccccc2)c2ccccc2)c1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 1/20 0.44
OPRK1 P41145 6/20 0.44
OPRM1 P35372 6/20 0.44
OPRD1 P41143 6/20 0.44
KCNH2 Q12809 3/20 0.44
PARP14 Q460N5 1/20 0.40
PARP1 P09874 1/20 0.40

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
SCHEMBL8938422 0.90 OPRD1 (0.44) OPRK1OPRM1OPRD1
SCHEMBL8938406 0.88 CYP4F2 (0.46) OPRM1
SCHEMBL8938362 0.87 HTR1A (0.44) OPRK1OPRM1OPRD1
SCHEMBL8938195 0.85 SIGMAR1 (0.44) OPRK1
SCHEMBL8938354 0.85 OPRM1 (0.43) OPRK1OPRM1OPRD1
SCHEMBL8938348 0.83 HTR2A (0.41)
SCHEMBL8938423 0.82 OPRM1 (0.42) OPRK1OPRM1KCNH2
SCHEMBL8938226 0.82 HRH3 (0.40) OPRM1KCNH2
SCHEMBL8938400 0.81 HRH3 (0.44) OPRD1
SCHEMBL8938428 0.81 HRH3 (0.58) SLC6A4

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-5534626-A SELECTIVE MUSCARINIC RECEPTOR ANTAGONIST INTERMEDIATES PFIZER INC. (US) 1996-07-09 US disclosed
US-5410046-A Selective muscarinic receptor antagonists PFIZER INC. (US) 1995-04-25 US disclosed
US-5231104-A Anticholinergic PFIZER INC. (US) 1993-07-27 US disclosed
EP-0350309-B1 PIPERIDINE DERIVATIVES Pfizer Limited (GB) 1992-11-11 EP disclosed
US-5089505-A Anticholinergic agents PFIZER INC. (US) 1992-02-18 US disclosed
EP-0350309-A1 Piperidine derivatives Pfizer Limited (GB) 1990-01-10 EP disclosed