SCHEMBL10514775

SCHEMBL10514775

CNC(=O)N1CCC(Oc2cccc(C(F)(F)F)c2)(c2ccccc2)CC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CHRM4 P08173 3/20 0.46
▸ FAAH O00519 2/20 0.45
▸ EPHX2 P34913 1/20 0.44
▸ DRD2 P14416 1/20 0.44
▸ LMNA P02545 4/20 0.43
▸ OPRM1 P35372 2/20 0.43
▸ OPRL1 P41146 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ GAA P10253 3/20 0.41
▸ GRIN2B Q13224 2/20 0.41
▸ HSD17B10 Q99714 2/20 0.41
▸ MAPT P10636 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ CYP3A4 P08684 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ USP2 O75604 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ TSHR P16473 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
SCHEMBL10513647 0.88 TRPM8 (0.43) CHRM4FAAHEPHX2DRD2OPRM1
SCHEMBL10516337 0.88 TACR1 (0.52) FAAHEPHX2DRD2LMNAOPRM1
SCHEMBL10516317 0.84 DRD2 (0.46) CHRM4DRD2LMNAOPRM1OPRL1
SCHEMBL10513911 0.82 KMT2A (0.55) FAAHLMNAHTTGAACYP3A4
SCHEMBL10513079 0.79 FKBP1A (0.41) FAAHEPHX2GRIN2BSMN1; SMN2ALDH1A1
SCHEMBL10515329 0.78 TRPM8 (0.57) FAAHEPHX2MAPTCYP3A4
SCHEMBL10513175 0.76 HDAC3 (0.43) OPRM1SMN1; SMN2CYP3A4CYP2C19POLB
SCHEMBL10515488 0.75 TACR1 (0.49) EPHX2DRD2OPRM1OPRL1CYP2C19
SCHEMBL10512960 0.75 TACR1 (0.52) EPHX2DRD2OPRM1OPRL1GAA
SCHEMBL10515881 0.74 TACR1 (0.52) DRD2TACR1ALDH1A1

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
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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