SCHEMBL7370530

SCHEMBL7370530

O=C1NCC[C@@H]1NCCc1ccc(OCc2cccc(F)c2)cc1

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAOB P27338 13/20 0.51
MAOA P21397 3/20 0.46
OPRL1 P41146 1/20 0.45
KCNH2 Q12809 3/20 0.45
NR4A2 P43354 1/20 0.45
PARP10 Q53GL7 1/20 0.44
SCN3A Q9NY46 2/20 0.43
OPRM1 P35372 1/20 0.43
OPRD1 P41143 1/20 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
SCHEMBL7370536 1.00 MAOB (0.51) MAOBMAOAOPRL1KCNH2NR4A2
SCHEMBL1346598 0.89 MAOB (0.50) MAOBMAOAKCNH2NR4A2
SCHEMBL1345209 0.89 MAOB (0.50) MAOBMAOAKCNH2NR4A2
SCHEMBL7370303 0.88 MAOB (0.50) MAOBMAOA
SCHEMBL7371960 0.88 FFAR1 (0.50) MAOBMAOAPARP10
SCHEMBL1346673 0.83 MAOB (0.48) MAOBMAOAKCNH2NR4A2SCN3A
SCHEMBL7369966 0.83 MAOB (0.48) MAOBMAOAKCNH2NR4A2SCN3A
SCHEMBL7372317 0.82 KDM4E (0.51) MAOBMAOAKCNH2SCN3A
SCHEMBL1346165 0.82 KDM4E (0.51) MAOBMAOAKCNH2SCN3A
SCHEMBL7378367 0.82 FFAR1 (0.48) MAOBMAOAPARP10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0842152-B1 N-(4-SUBSTITUTED-BENZYL)-2-AMINOLACTAM DERIVATIVES NEWRON PHARM SPA (IT) 2001-01-31 EP disclosed
US-5912242-A ANTIEPILEPTIC, ANTI-PARKINSON, ANTIDEPRESSANT, ANTISPASMODIC, NEUROPROTECTIVE OR HYPNOTIC AGENTS, FOR TREATMENT OF NEURODEGENERATIVE DISEASES PHARMACIA & UPJOHN S.P.A. (IT) 1999-06-15 US disclosed
EP-0842152-A1 N-(4-SUBSTITUTED-BENZYL)-2-AMINOLACTAM DERIVATIVES PHARMACIA & UPJOHN S.p.A. (IT) 1998-05-20 EP disclosed
WO-1997005111-A1 N-(4-SUBSTITUTED-BENZYL)-2-AMINOLACTAM DERIVATIVES PHARMACIA & UPJOHN S.P.A. (IT) 1997-02-13 WO disclosed