SCHEMBL8742178

SCHEMBL8742178

Cc1cc2ccc(CC(=O)N3CC=C(c4cccc(C(F)(F)F)c4)CC3)cc2cc1C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.48
▸ KMT2A Q03164 3/20 0.48
▸ CYP1A2 P05177 1/20 0.48
▸ CYP3A4 P08684 1/20 0.48
▸ CYP2D6 P10635 1/20 0.48
▸ CYP2C9 P11712 1/20 0.48
▸ CYP2C19 P33261 1/20 0.48
▸ NPSR1 Q6W5P4 1/20 0.48
▸ PPARG P37231 1/20 0.45
▸ PPARA Q07869 1/20 0.45
▸ CCR2 P41597 1/20 0.43
▸ SOS1 Q07889 1/20 0.43
▸ SYK P43405 2/20 0.40
▸ LIMK1 P53667 1/20 0.40
▸ LIMK2 P53671 1/20 0.40
▸ HTR2C P28335 2/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ CNR1 P21554 1/20 0.39
▸ KCNK3 O14649 1/20 0.38
▸ CCNC P24863 1/20 0.38

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
SCHEMBL2845133 0.91 MEN1 (0.50) MEN1KMT2ACYP1A2CYP3A4CYP2D6
SCHEMBL8742207 0.90 KMT2A (0.45) MEN1KMT2ACYP1A2CYP3A4CYP2D6
SCHEMBL8742167 0.89 PPARG (0.47) MEN1KMT2ACYP1A2CYP3A4CYP2D6
SCHEMBL10939339 0.83 MEN1 (0.50) MEN1KMT2APPARGPPARACCR2
SCHEMBL9366593 0.82 PPARG (0.51) MEN1KMT2ACYP1A2CYP3A4CYP2D6
Hydrochloric Acid SCHEMBL8742364 0.81 PPARG (0.50) MEN1KMT2ACYP1A2CYP3A4CYP2D6
SCHEMBL10935421 0.79 MEN1 (0.49) MEN1KMT2ACYP1A2CYP3A4CYP2D6
SCHEMBL187309 0.78 MEN1 (0.50) MEN1KMT2ANPSR1PPARGPPARA
Hydrochloric Acid SCHEMBL10734951 0.78 MEN1 (0.53) MEN1KMT2APPARGPPARACCR2
SCHEMBL2845134 0.78 KDM4E (0.47) MEN1KMT2ACYP2C9CCR2SOS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5618822-A N-substituted trifluoromethylphenyltetrahydropyridines, process for the preparation thereof, intermediates in said process and pharmaceutical compositions containing them SANOFI (FR) 1997-04-08 — — US disclosed
US-5599941-A N-substituted trifluoromethylphenyltetrahydropyridines process for the preparation thereof intermediates in said process and pharmaceutical compositions containing them SANOFI (FR) 1997-02-04 — — US disclosed
US-5596101-A N-substituted trifluoromethylphenyltetrahydropyridines, process for the preparation thereof, intermediates in said process and pharmaceutical compositions containing them SANOFI (FR) 1997-01-21 — — US disclosed
US-5559238-A N-substituted trifluoromethylphenyltetrahydropyridenes process for the preparation thereof, intermediates in said process and pharmaceutical compositions containing them SANOFI (FR) 1996-09-24 — — US disclosed
US-5462945-A N-substituted trifluoromethylphenyltetrahydropyridines, process for the preparation thereof, intermediates in said process and pharmaceutical compositions containing them SANOFI (FR) 1995-10-31 — — US disclosed
EP-0458697-B1 N-substituted trifluoromethylphenyl tetrahydropyridines, process for their preparation, intermediates and pharmaceutical preparations containing them SANOFI ELF (FR) 1994-07-27 — — EP disclosed
US-5281606-A N-substituted trifluoromethylphenyltetrahydropyridines, process for the preparation thereof, intermediates in said process and pharmaceutical compositions containing them SANOFI (FR) 1994-01-25 — — US disclosed
EP-0458697-A1 N-substituted trifluoromethylphenyl tetrahydropyridines, process for their preparation, intermediates and pharmaceutical preparations containing them ELF SANOFI (FR) 1991-11-27 — — EP disclosed
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