SCHEMBL8797253

SCHEMBL8797253

COc1cccc2c1OCN(CCOc1ccc(C=O)cc1)C2=O

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.41
HPGD P15428 3/20 0.39
ALDH1A1 P00352 2/20 0.39
MAPT P10636 1/20 0.39
NPC1 O15118 2/20 0.39
ATM Q13315 1/20 0.39
RXFP1 Q9HBX9 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
ACHE P22303 2/20 0.36
MAOB P27338 1/20 0.36
HEXA P06865 2/20 0.36
HEXB P07686 2/20 0.36
KCNH2 Q12809 1/20 0.36
HRH3 Q9Y5N1 1/20 0.36

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
SCHEMBL8575290 0.86 KMT2A (0.50) RAB9AHPGDALDH1A1MAPTNPC1
SCHEMBL8797533 0.85 MEN1 (0.52) HPGDMAOBHRH3
SCHEMBL8797532 0.85 MEN1 (0.52) HPGDMAOBHRH3
SCHEMBL8797536 0.83 CSNK2A2 (0.47) HPGDMAOBHRH3
SCHEMBL6949825 0.80 ACHE (0.45) RAB9AHPGDNPC1NPSR1ACHE
SCHEMBL8796940 0.79 MAOB (0.43) RAB9AHPGDALDH1A1MAPTNPC1
SCHEMBL8803534 0.79 MAOB (0.48) ACHEMAOB
SCHEMBL8796845 0.78 FFAR1 (0.49) HPGDALDH1A1MAPTHRH3
SCHEMBL8572986 0.77 DRD2 (0.39) ALDH1A1MAPT
SCHEMBL8796826 0.75 MAOB (0.48) RAB9AMAPTACHEMAOB

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
EP-0787727-A1 Benzoazine derivative or salt thereof and pharmaceutical composition comprising the same SS Pharmaceutical Co., Ltd. (JP) 1997-08-06 EP disclosed