SCHEMBL8432192

SCHEMBL8432192

CC(C)C(=O)NNCc1ccc(NCc2cccc(F)c2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 2/20 0.57
PPARA Q07869 1/20 0.47
MAOB P27338 3/20 0.45
MAOA P21397 1/20 0.45
SCN9A Q15858 1/20 0.45
ANPEP P15144 1/20 0.44
LMNA P02545 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
MEN1 O00255 1/20 0.44
ALDH1A1 P00352 1/20 0.44
MAPT P10636 1/20 0.44
THRB P10828 1/20 0.44
PKM P14618 1/20 0.44
RECQL P46063 1/20 0.44
RAB9A P51151 1/20 0.44
BLM P54132 1/20 0.44
CASP6 P55212 1/20 0.44
KMT2A Q03164 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
HIF1A Q16665 2/20 0.43

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
SCHEMBL8431815 0.82 MAOB (0.67) PPARAMAOBMAOASCN9A
SCHEMBL8755027 0.78 MAOB (0.68) FFAR1MAOBMAOASCN9A
Hydrochloric Acid SCHEMBL8755428 0.77 MAOB (0.67) FFAR1MAOBMAOASCN9A
Hydrochloric Acid SCHEMBL8755417 0.77 MAOB (0.67) FFAR1MAOBMAOASCN9A
SCHEMBL8755053 0.77 FFAR1 (0.59) FFAR1PPARAMAOBMAOASCN9A
SCHEMBL6692696 0.77 FFAR1 (0.67) FFAR1MAOBLMNAL3MBTL1MEN1
SCHEMBL8432196 0.76 FFAR1 (0.55) FFAR1PPARAMAOBMAOASCN9A
SCHEMBL13797510 0.76 ANPEP (0.60) ANPEPALDH1A1RAB9AEPHX2
SCHEMBL22369511 0.75 GAA (0.55) LMNAL3MBTL1MEN1ALDH1A1MAPT
SCHEMBL2195496 0.73 FFAR1 (0.68) FFAR1PPARAMEN1ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5945454-A 2-(4-substituted)-benzylamino-2-methyl-propanamide derivatives PHARMACIA & UPJOHN, S.P.A. (IT) 1999-08-31 US disclosed