SCHEMBL11256014

SCHEMBL11256014

COc1cc(C(O)C(C)N2CCC(n3c(=O)[nH]c4ccccc43)C(C)C2)cc(OC)c1OC

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 12/20 0.47
PLD1 Q13393 5/20 0.46
PLD2 O14939 4/20 0.46
OPRD1 P41143 1/20 0.42
OPRK1 P41145 1/20 0.42
OPRL1 P41146 1/20 0.42
HSD11B1 P28845 2/20 0.42
ABL1 P00519 1/20 0.41
RIN1 Q13671 1/20 0.41

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
SCHEMBL11033261 0.87 OPRM1 (0.60) OPRM1PLD1PLD2OPRD1OPRK1
SCHEMBL11217080 0.85 PLD2 (0.50) OPRM1PLD1PLD2OPRD1OPRK1
SCHEMBL11199327 0.84 PLD1 (0.51) OPRM1PLD1PLD2OPRD1OPRL1
SCHEMBL11199325 0.84 PLD1 (0.51) OPRM1PLD1PLD2OPRD1OPRL1
SCHEMBL11199321 0.84 PLD1 (0.51) OPRM1PLD1PLD2OPRD1OPRL1
SCHEMBL11206487 0.84 PLD1 (0.51) OPRM1PLD1PLD2OPRD1OPRL1
SCHEMBL11221635 0.79 PLD1 (0.51) OPRM1PLD1PLD2OPRD1OPRK1
SCHEMBL11221627 0.79 PLD2 (0.43) OPRM1PLD1PLD2OPRK1
SCHEMBL11031960 0.78 OPRM1 (0.62) OPRM1PLD1PLD2OPRD1OPRK1
SCHEMBL11250457 0.77 OPRM1 (0.52) OPRM1OPRD1OPRK1OPRL1HSD11B1

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
EP-0092391-A2 Novel piperidine derivatives and pharmaceutical compositions containing same KYOWA HAKKO KOGYO CO., LTD (JP) 1983-10-26 EP disclosed