SCHEMBL11034834

SCHEMBL11034834

NC(=O)COCCOCCN1CCC(=C(c2ccccc2)c2ccccc2)CC1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 5/20 0.52
OPRM1 P35372 4/20 0.52
OPRK1 P41145 4/20 0.52
P2RX7 Q99572 1/20 0.46
SETD7 Q8WTS6 1/20 0.46
TACR1 P25103 1/20 0.44
DRD2 P14416 1/20 0.43
DRD4 P21917 1/20 0.43
HTR2A P28223 1/20 0.43
HTR2C P28335 1/20 0.43
HTR2B P41595 1/20 0.43
KDM4E B2RXH2 3/20 0.43
ALDH1A1 P00352 3/20 0.43
POLB P06746 1/20 0.42
RECQL P46063 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HTR7 P34969 1/20 0.42
FNTA P49354 1/20 0.40
FNTB P49356 1/20 0.40
LMNA P02545 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
Hydrochloric Acid SCHEMBL11034648 0.99 OPRD1 (0.51) OPRD1OPRM1OPRK1P2RX7SETD7
SCHEMBL11034679 0.93 OPRK1 (0.49) OPRD1OPRM1OPRK1P2RX7DRD2
SCHEMBL11036099 0.91 DRD2 (0.55) OPRD1OPRM1OPRK1P2RX7TACR1
SCHEMBL11097971 0.91 OPRD1 (0.51) OPRD1OPRM1OPRK1P2RX7SETD7
Pibaxizine SCHEMBL1231070 0.90 OPRD1 (0.51) OPRD1OPRM1OPRK1P2RX7SETD7
Hydrochloric Acid SCHEMBL11036480 0.90 OPRD1 (0.50) OPRD1OPRM1OPRK1P2RX7SETD7
Pibaxizine SCHEMBL11033265 0.89 OPRD1 (0.50) OPRD1OPRM1OPRK1P2RX7SETD7
SCHEMBL11037592 0.89 OPRD1 (0.52) OPRD1OPRM1OPRK1SETD7DRD2
Hydrochloric Acid SCHEMBL11037583 0.88 OPRD1 (0.51) OPRD1OPRM1OPRK1DRD2HTR2A
SCHEMBL11034385 0.87 OPRD1 (0.53) OPRD1OPRM1OPRK1P2RX7SETD7

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