SCHEMBL2175693

SCHEMBL2175693

CN(C(=O)c1n[nH]c2c1COc1ccccc1-2)c1ccccc1C(N)=O

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALPL P05186 2/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
HSD17B10 Q99714 1/20 0.41
PIK3CA P42336 9/20 0.39
KMT2A Q03164 1/20 0.36
TP53 P04637 6/20 0.36
MAPT P10636 4/20 0.36
PIK3CB P42338 2/20 0.35
PARP1 P09874 1/20 0.35
POLB P06746 1/20 0.33
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL2172957 0.85 PIK3CA (0.53) ALPLKDM4EALDH1A1HSD17B10PIK3CA
SCHEMBL30290797 0.82 KDM4E (0.51) ALPLKDM4EALDH1A1HSD17B10KMT2A
SCHEMBL2173919 0.79 GPBAR1 (0.44) ALPLKDM4EALDH1A1HSD17B10PIK3CA
SCHEMBL2171308 0.79 PIK3CA (0.53) ALPLKDM4EALDH1A1HSD17B10PIK3CA
SCHEMBL2172385 0.77 KDM4E (0.39) ALPLKDM4EALDH1A1HSD17B10PIK3CA
SCHEMBL2173092 0.77 PIK3CA (0.44) ALPLKDM4EALDH1A1HSD17B10PIK3CA
SCHEMBL2171484 0.77 POLB (0.49) PIK3CAKMT2ATP53MAPTPOLB
SCHEMBL2172245 0.76 TP53 (0.41) ALPLKDM4EALDH1A1HSD17B10PIK3CA
SCHEMBL2173329 0.76 GPBAR1 (0.47) ALPLKDM4EALDH1A1HSD17B10PIK3CA
SCHEMBL2171482 0.76 KDM4E (0.59) ALPLKDM4EALDH1A1HSD17B10KMT2A

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 claimed
WO-2010049366-A1 TRICYCLIC COMPOUNDS AS GLUTAMATE RECEPTOR MODULATORS GLAXO GROUP LIMITED (GB) 2010-05-06 WO claimed