SCHEMBL5684175

SCHEMBL5684175

CS(=O)(=O)OC(NCc1ccc(OCc2cccc(F)c2)cc1)(C(N)=O)c1cccc(F)c1

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOB P27338 9/20 0.56
MAOA P21397 2/20 0.56
SCN9A Q15858 1/20 0.56
PARP10 Q53GL7 1/20 0.51
PPARA Q07869 1/20 0.48
NR4A2 P43354 1/20 0.47
GRM5 P41594 1/20 0.46

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
SCHEMBL5680344 0.94 MAOB (0.49) MAOBMAOASCN9APARP10
SCHEMBL5684098 0.88 MAOB (0.53) MAOBMAOASCN9APARP10PPARA
SCHEMBL5682138 0.85 ALDH1A1 (0.47) MAOBPARP10
SCHEMBL5681627 0.84 GID4 (0.52) MAOBMAOA
SCHEMBL5681586 0.84 PARP15 (0.50) MAOBMAOAPARP10
SCHEMBL5684577 0.81 FFAR1 (0.49) MAOBMAOASCN9APPARA
SCHEMBL1067948 0.80 MAOB (0.65) MAOBMAOASCN9APARP10PPARA
SCHEMBL5684437 0.80 SCN3A (0.55) MAOBSCN9APARP10
SCHEMBL5684554 0.79 TP53 (0.41) MAOBMAOASCN9A
SCHEMBL5536874 0.77 MAOB (0.53) MAOBMAOASCN9APARP10PPARA

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-1044186-B9 SUBSTITUTED 2-BENZYLAMINO-2-PHENYL-ACETAMIDE COMPOUNDS NEWRON PHARM SPA (IT) 2006-06-21 EP disclosed
EP-1044186-B1 SUBSTITUTED 2-BENZYLAMINO-2-PHENYL-ACETAMIDE COMPOUNDS NEWRON PHARM SPA (IT) 2006-03-08 EP disclosed
US-6303819-B1 SODIUM CHANNEL-BLOCKING AGENT; CHRONIC OR NEUROPATHIC PAIN. NEWRON PHARMACEUTICALS S.P.A. (IT) 2001-10-16 US disclosed