SCHEMBL8980596

SCHEMBL8980596

Cc1cc2c(cc1C)C(=O)N(CCO)CO2

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
IMPDH2 P12268 1/20 0.37
IMPDH1 P20839 1/20 0.37
KDM4E B2RXH2 4/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
LMNA P02545 1/20 0.32
TP53 P04637 1/20 0.32
POLB P06746 1/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
RECQL P46063 1/20 0.32
BLM P54132 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
KMO O15229 1/20 0.31
GABRA1 P14867 1/20 0.30

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
SCHEMBL8368757 0.89 KDM4E (0.35) KDM4E
SCHEMBL8575685 0.82 CYP19A1 (0.39) KDM4E
SCHEMBL9174068 0.82 MEN1 (0.43) KDM4EMEN1KMT2AMAPT
SCHEMBL8641729 0.78 MAOA (0.45) KDM4E
SCHEMBL8636633 0.78 MAPT (0.41) KDM4EKMT2AMAPT
SCHEMBL8980607 0.77 PARP1 (0.39) KMT2ALMNAMAPTL3MBTL1GABRA1
SCHEMBL8980601 0.77 APP (0.39) MEN1KMT2A
SCHEMBL8573189 0.77 MAOB (0.40) MAPTTDP1KMO
SCHEMBL8980735 0.77 DPP4 (0.39) KDM4ETDP1KMO
SCHEMBL8640110 0.77 ALDH1A1 (0.40) KDM4EMEN1KMT2ALMNATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0711286-A1 BENZOXAZINONES AND BENZOTHIAZINONES ENDOWED WITH THERAPEUTIC ACTIVITY ITALFARMACO S.p.A. (IT) 1996-05-15 EP disclosed
WO-1995004048-A1 BENZOXAZINONES AND BENZOTHIAZINONES ENDOWED WITH THERAPEUTIC ACTIVITY ITALFARMACO S.P.A. (IT) 1995-02-09 WO disclosed