SCHEMBL10937656

SCHEMBL10937656

O=C(CCc1cccc2ccccc12)N1CC=C(c2cccc(C(F)(F)F)c2)CC1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.49
▸ KMT2A Q03164 2/20 0.49
▸ KDM4E B2RXH2 2/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ PARP1 P09874 3/20 0.46
▸ PARP2 Q9UGN5 1/20 0.46
▸ PTGER2 P43116 1/20 0.43
▸ PTGDR2 Q9Y5Y4 1/20 0.43
▸ CCR2 P41597 1/20 0.42
▸ SOS1 Q07889 1/20 0.41
▸ USP2 O75604 2/20 0.41
▸ MCL1 Q07820 1/20 0.41
▸ BAD Q92934 1/20 0.41
▸ MAPT P10636 3/20 0.40
▸ LMNA P02545 2/20 0.40
▸ HTT P42858 2/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ HTR7 P34969 1/20 0.40
▸ POLB P06746 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
SCHEMBL2845134 0.90 KDM4E (0.47) MEN1KMT2AKDM4EALDH1A1PTGDR2
SCHEMBL10939339 0.85 MEN1 (0.50) MEN1KMT2AKDM4EALDH1A1PARP1
Hydrochloric Acid SCHEMBL10734951 0.83 MEN1 (0.53) MEN1KMT2ACCR2SOS1USP2
SCHEMBL1821251 0.81 HTR7 (0.51) MEN1KMT2AKDM4EPARP1MAPT
SCHEMBL10937671 0.81 MEN1 (0.49) MEN1KMT2AALDH1A1PARP1PARP2
Hydrochloric Acid SCHEMBL9486649 0.80 HTR7 (0.50) MEN1KMT2AKDM4EPARP1MAPT
SCHEMBL10976765 0.79 HTR7 (0.54) MEN1KMT2AKDM4EPARP1MAPT
SCHEMBL187309 0.79 MEN1 (0.50) MEN1KMT2AALDH1A1CCR2SOS1
SCHEMBL10976819 0.78 HTR7 (0.55) PARP1MAPTHTR7TSHR
Hydrochloric Acid SCHEMBL10936177 0.78 HTR7 (0.53) MEN1KMT2AKDM4EPARP1MAPT

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-0101381-B1 ANOREXIC TRIFLUOROMETHYL PHENYL TETRAHYDROPYRIDINES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SANOFI S.A. (FR) 1985-12-04 — — EP disclosed
US-4521428-A Anorexigenic trifluoromethylphenyltetrahydropyridines and pharmaceutical compositions containing them SANOFI (FR) 1985-06-04 — — US disclosed
EP-0101381-A1 Anorexic trifluoromethyl phenyl tetrahydropyridines, process for their preparation and pharmaceutical compositions containing them SANOFI S.A. (FR) 1984-02-22 — — EP disclosed
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