SCHEMBL2175753

SCHEMBL2175753

COc1ccc(Cl)cc1CNC(=O)c1n[nH]c2c1COc1ccccc1-2

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.47
NPC1 O15118 2/20 0.44
KDM4E B2RXH2 2/20 0.44
ALDH1A1 P00352 2/20 0.44
GAA P10253 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
ANO1 Q5XXA6 1/20 0.41
ANO2 Q9NQ90 1/20 0.41
ROCK2 O75116 2/20 0.41
TP53 P04637 3/20 0.40
ROCK1 Q13464 1/20 0.40
POLB P06746 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
EIF2AK1 Q9BQI3 1/20 0.40
HPGD P15428 1/20 0.39
HSD17B10 Q99714 1/20 0.39

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
SCHEMBL2171484 0.79 POLB (0.49) MAPTMEN1KMT2ATP53POLB
SCHEMBL2175482 0.76 ROCK2 (0.49) MAPTNPC1ALDH1A1GAAMEN1
SCHEMBL2171311 0.75 ALDH1A1 (0.45) MAPTNPC1KDM4EALDH1A1KMT2A
SCHEMBL2172661 0.73 CDK2 (0.54) MAPTNPC1ALDH1A1GAAL3MBTL1
SCHEMBL2173548 0.72 FLT3 (0.56) MAPTNPC1KDM4EALDH1A1GAA
SCHEMBL2173092 0.72 PIK3CA (0.44) MAPTKDM4EALDH1A1MEN1KMT2A
SCHEMBL2175776 0.71 NPC1 (0.48) MAPTNPC1KDM4EALDH1A1GAA
SCHEMBL2175786 0.71 KDM4E (0.38) MAPTKDM4EALDH1A1GAAROCK2
SCHEMBL2173919 0.70 GPBAR1 (0.44) MAPTKDM4EALDH1A1GAATP53
SCHEMBL2173329 0.70 GPBAR1 (0.47) MAPTKDM4EALDH1A1KMT2ATP53

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-2346832-A1 TRICYCLIC COMPOUNDS AS GLUTAMATE RECEPTOR MODULATORS Glaxo Group Limited (GB) 2011-07-27 EP disclosed
WO-2010049366-A1 TRICYCLIC COMPOUNDS AS GLUTAMATE RECEPTOR MODULATORS GLAXO GROUP LIMITED (GB) 2010-05-06 WO disclosed