SCHEMBL7378463

SCHEMBL7378463

O=C1NCC[C@@H]1NCc1ccc(OCc2ccc(F)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.46
APOL1 O14791 1/20 0.45
PTPN1 P18031 1/20 0.44
S1PR5 Q9H228 1/20 0.44
MAOB P27338 6/20 0.43
APP P05067 1/20 0.43
HTR1A P08908 2/20 0.43
SLC6A2 P23975 2/20 0.43
SLC6A4 P31645 2/20 0.43
SLC6A3 Q01959 2/20 0.43
KCNH2 Q12809 1/20 0.43
KDM1A O60341 1/20 0.43
NR4A2 P43354 1/20 0.43
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA7 P43166 1/20 0.42
CA9 Q16790 1/20 0.42
PARP10 Q53GL7 1/20 0.42

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
SCHEMBL1346381 1.00 ALDH1A1 (0.46) ALDH1A1APOL1PTPN1S1PR5MAOB
SCHEMBL1346835 0.93 ALDH1A1 (0.44) ALDH1A1PTPN1S1PR5MAOBAPP
SCHEMBL1344438 0.92 PSEN1 (0.46) ALDH1A1PTPN1S1PR5APPKCNH2
SCHEMBL1347012 0.89 KDM1A (0.52) APOL1KDM1A
SCHEMBL1346696 0.88 FOXM1 (0.46) MAOBAPPNR4A2
SCHEMBL1346938 0.88 MEN1 (0.48) ALDH1A1MAOBAPP
SCHEMBL7370997 0.88 FOXM1 (0.46) MAOBAPPNR4A2
SCHEMBL1346598 0.88 MAOB (0.50) MAOBKCNH2NR4A2
SCHEMBL1345209 0.88 MAOB (0.50) MAOBKCNH2NR4A2
SCHEMBL1346576 0.87 SCN9A (0.49) PTPN1MAOB

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-0842152-B1 N-(4-SUBSTITUTED-BENZYL)-2-AMINOLACTAM DERIVATIVES NEWRON PHARM SPA (IT) 2001-01-31 EP 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