SCHEMBL10512960

SCHEMBL10512960

CC(=O)N1CCC(Oc2ccc(C(F)(F)F)cc2)(c2ccccc2)CC1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TACR1 P25103 2/20 0.52
▸ DRD2 P14416 2/20 0.43
▸ RORC P51449 2/20 0.43
▸ MEN1 O00255 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ TP53 P04637 1/20 0.42
▸ MDM2 Q00987 1/20 0.42
▸ USP2 O75604 3/20 0.42
▸ THRB P10828 1/20 0.41
▸ CYP2C19 P33261 2/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ OPRM1 P35372 1/20 0.41
▸ OPRL1 P41146 1/20 0.41
▸ EPHX2 P34913 2/20 0.40
▸ HPGD P15428 1/20 0.40
▸ EPHX1 P07099 1/20 0.40
▸ GAA P10253 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
SCHEMBL10515488 0.95 TACR1 (0.49) TACR1DRD2RORCMEN1RAB9A
SCHEMBL10514541 0.88 THRB (0.41) TACR1DRD2TP53MDM2THRB
SCHEMBL10515742 0.87 OPRM1 (0.44) TACR1DRD2MEN1KMT2ATHRB
SCHEMBL10516337 0.87 TACR1 (0.52) TACR1DRD2MEN1RAB9AKMT2A
SCHEMBL10513647 0.87 TRPM8 (0.43) TACR1DRD2USP2THRBOPRM1
SCHEMBL11740042 0.86 CYP3A4 (0.48) TP53USP2CYP2C19ALDH1A1MAPK1
SCHEMBL11224032 0.83 DRD2 (0.50) TACR1DRD2OPRM1OPRL1
SCHEMBL10515329 0.81 TRPM8 (0.57) THRBEPHX2
SCHEMBL10483337 0.81 TACR1 (0.47) TACR1DRD2MEN1RAB9AKMT2A
SCHEMBL10513967 0.80 USP2 (0.46) MEN1RAB9AKMT2AUSP2CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0333025-A1 1-Carbonylderivatives of 4-aryl-4-aryloxypiperidines, a process for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1989-09-20 — — EP claimed
US-4853384-A ANTICONVULSANTS; HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1989-08-01 — — US claimed
EP-0333025-A1 1-Carbonylderivatives of 4-aryl-4-aryloxypiperidines, a process for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1989-09-20 — — EP disclosed
US-4853384-A ANTICONVULSANTS; HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1989-08-01 — — US disclosed
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