SCHEMBL11099119

SCHEMBL11099119

NC(=O)COCCN1CCC(=C(c2ccccc2)c2ccccc2Cl)CC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.44
OPRD1 P41143 1/20 0.44
OPRK1 P41145 1/20 0.44
KCNA5 P22460 1/20 0.44
HPGD P15428 1/20 0.44
TACR1 P25103 1/20 0.40
HRH1 P35367 3/20 0.40
DRD3 P35462 2/20 0.40
SLC6A2 P23975 1/20 0.40
HRH2 P25021 1/20 0.40
HTR2A P28223 1/20 0.40
SLC6A4 P31645 1/20 0.40
HTR2B P41595 1/20 0.40
SLC6A3 Q01959 1/20 0.40
TEK Q02763 1/20 0.40
KCNH2 Q12809 1/20 0.40
USP2 O75604 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
BCHE P06276 1/20 0.39
ACHE P22303 1/20 0.39

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 SCHEMBL11034451 0.99 HPGD (0.46) OPRM1OPRD1OPRK1KCNA5HPGD
SCHEMBL11035757 0.91 HRH1 (0.48) OPRM1OPRD1OPRK1KCNA5HPGD
Hydrochloric Acid SCHEMBL11034791 0.90 HRH1 (0.49) OPRM1OPRD1OPRK1KCNA5HPGD
SCHEMBL11097971 0.87 OPRD1 (0.51) OPRM1OPRD1OPRK1KCNA5TACR1
SCHEMBL11034834 0.86 OPRD1 (0.52) OPRM1OPRD1OPRK1TACR1HTR2A
Hydrochloric Acid SCHEMBL11036480 0.86 OPRD1 (0.50) OPRM1OPRD1OPRK1KCNA5TACR1
Hydrochloric Acid SCHEMBL11034648 0.85 OPRD1 (0.51) OPRM1OPRD1OPRK1TACR1HRH1
SCHEMBL11034679 0.85 OPRK1 (0.49) OPRM1OPRD1OPRK1KCNA5HRH1
SCHEMBL11036099 0.82 DRD2 (0.55) OPRM1OPRD1OPRK1TACR1HTR2A
SCHEMBL11037592 0.80 OPRD1 (0.52) OPRM1OPRD1OPRK1KCNA5HRH1

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 3 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