SCHEMBL11037592

SCHEMBL11037592

COc1ccc(C(=C2CCN(CCOCC(N)=O)CC2)c2ccccc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 2/20 0.52
OPRM1 P35372 1/20 0.52
OPRK1 P41145 1/20 0.52
DRD3 P35462 5/20 0.49
DRD2 P14416 6/20 0.48
KCNA5 P22460 1/20 0.48
HTR2A P28223 2/20 0.44
HTR1A P08908 2/20 0.44
SLC6A4 P31645 1/20 0.44
HTR7 P34969 1/20 0.44
HRH1 P35367 1/20 0.44
HTR2B P41595 1/20 0.44
SETD7 Q8WTS6 1/20 0.43
LTA4H P09960 1/20 0.43
PSMB1 P20618 1/20 0.43
PSMB5 P28074 1/20 0.43
PSMB2 P49721 1/20 0.43

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
Hydrochloric Acid SCHEMBL11037583 0.99 OPRD1 (0.51) OPRD1OPRM1OPRK1DRD3DRD2
Hydrochloric Acid SCHEMBL11034928 0.90 DRD3 (0.50) OPRD1OPRM1OPRK1DRD3DRD2
SCHEMBL11034834 0.89 OPRD1 (0.52) OPRD1OPRM1OPRK1DRD2HTR2A
Hydrochloric Acid SCHEMBL11034648 0.88 OPRD1 (0.51) OPRD1OPRM1OPRK1DRD2HTR2A
SCHEMBL11097971 0.87 OPRD1 (0.51) OPRD1OPRM1OPRK1DRD3DRD2
SCHEMBL11036099 0.87 DRD2 (0.55) OPRD1OPRM1OPRK1DRD2HTR2A
Hydrochloric Acid SCHEMBL11036480 0.86 OPRD1 (0.50) OPRD1OPRM1OPRK1DRD3DRD2
SCHEMBL11034679 0.85 OPRK1 (0.49) OPRD1OPRM1OPRK1DRD3DRD2
SCHEMBL11034385 0.81 OPRD1 (0.53) OPRD1OPRM1OPRK1DRD3HTR2A
SCHEMBL11543462 0.81 HTR1A (0.67) OPRD1OPRM1OPRK1DRD3DRD2

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-0048705-B1 2-(4-(DIPHENYLMETHYLENE)-1-PIPERIDINYL)-ACETIC ACIDS AND THEIR AMIDES, THEIR PREPARATION AND PHARMACEUTICAL PREPARATIONS CONTAINING THEM U C B, S.A. (BE) 1984-07-11 EP claimed
EP-0048705-A1 2-(4-(Diphenylmethylene)-1-piperidinyl)-acetic acids and their amides, their preparation and pharmaceutical preparations containing them U C B, S.A. (BE) 1982-03-31 EP claimed
EP-0048705-B1 2-(4-(DIPHENYLMETHYLENE)-1-PIPERIDINYL)-ACETIC ACIDS AND THEIR AMIDES, THEIR PREPARATION AND PHARMACEUTICAL PREPARATIONS CONTAINING THEM U C B, S.A. (BE) 1984-07-11 EP disclosed
US-4443460-A ANTIALLERGENS, ANTIHISTAMINES, ANTISPASMODICS, BRONCHODILATORS UCB, SOCIETE ANONYME (BE) 1984-04-17 US disclosed
EP-0048705-A1 2-(4-(Diphenylmethylene)-1-piperidinyl)-acetic acids and their amides, their preparation and pharmaceutical preparations containing them U C B, S.A. (BE) 1982-03-31 EP disclosed