SCHEMBL9227658

SCHEMBL9227658

CCC(=O)N(c1ccccc1)C1(C(=O)OC)CCN(C(CC)CC(=O)O)CC1

nearest known ligand 0.62

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 14/20 0.62
OPRD1 P41143 4/20 0.62
OPRK1 P41145 2/20 0.62
CACNA1C Q13936 1/20 0.62
OPRL1 P41146 1/20 0.45

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
SCHEMBL4236765 0.88 OPRM1 (0.63) OPRM1OPRD1OPRK1CACNA1COPRL1
SCHEMBL11565239 0.86 OPRM1 (0.68) OPRM1OPRD1OPRK1CACNA1COPRL1
SCHEMBL15817257 0.84 OPRM1 (0.66) OPRM1OPRD1OPRK1CACNA1COPRL1
SCHEMBL20953915 0.83 CACNA1C (0.68) OPRM1OPRD1OPRK1CACNA1COPRL1
SCHEMBL18623777 0.82 OPRM1 (0.76) OPRM1OPRD1OPRK1CACNA1COPRL1
SCHEMBL8989441 0.81 OPRM1 (0.82) OPRM1OPRD1OPRK1CACNA1COPRL1
SCHEMBL11563405 0.81 OPRM1 (0.68) OPRM1OPRD1OPRK1CACNA1COPRL1
SCHEMBL1952247 0.80 CACNA1C (0.86) OPRM1OPRD1OPRK1CACNA1C
SCHEMBL11563541 0.79 OPRM1 (0.82) OPRM1OPRD1OPRK1CACNA1C
SCHEMBL9797745 0.78 OPRM1 (0.80) OPRM1OPRD1OPRK1CACNA1COPRL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5466700-A Anesthetic use of N-phenyl-N-(4-piperidinyl)amides GLAXO WELLCOME INC. (US) 1995-11-14 US disclosed