SCHEMBL8434311

SCHEMBL8434311

CC(C)C(=O)NNCCc1ccc(OCc2cccc(F)c2)cc1

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAOB P27338 10/20 0.58
MAOA P21397 1/20 0.58
SCN9A Q15858 1/20 0.58
GRM5 P41594 1/20 0.54
NR4A2 P43354 1/20 0.54
PARP10 Q53GL7 1/20 0.53

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 0.88 MAOB (0.67) MAOBMAOASCN9AGRM5NR4A2
SCHEMBL964301 0.81 MAOB (0.80) MAOBMAOASCN9APARP10
SCHEMBL8434308 0.79 MAOB (0.64) MAOBMAOASCN9AGRM5NR4A2
SCHEMBL9626407 0.77 MAOB (0.69) MAOBMAOASCN9ANR4A2PARP10
SCHEMBL965290 0.77 MAOB (0.62) MAOBMAOASCN9ANR4A2PARP10
SCHEMBL5035179 0.77 MAOB (0.61) MAOBMAOASCN9AGRM5NR4A2
SCHEMBL3976085 0.76 MAOB (0.58) MAOBMAOASCN9AGRM5NR4A2
SCHEMBL14323980 0.76 MAOB (0.69) MAOBMAOASCN9AGRM5NR4A2
SCHEMBL8935244 0.76 MAOB (0.69) MAOBMAOASCN9AGRM5NR4A2
SCHEMBL4425539 0.75 MAOB (0.60) MAOBMAOASCN9AGRM5NR4A2

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