SCHEMBL9710434

SCHEMBL9710434

Cc1nc(C)n2c1c(C(=O)O)nc1ccccc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.48
HSD17B10 Q99714 4/20 0.48
MAPT P10636 3/20 0.48
POLB P06746 3/20 0.48
TP53 P04637 2/20 0.48
LMNA P02545 1/20 0.48
ALDH1A1 P00352 4/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
MAOA P21397 3/20 0.45
KMT2A Q03164 4/20 0.44
MEN1 O00255 3/20 0.44
GAA P10253 1/20 0.44
CASP1 P29466 2/20 0.44
CASP7 P55210 2/20 0.44
THRB P10828 1/20 0.44
HPGD P15428 1/20 0.44
KEAP1 Q14145 1/20 0.44
NFE2L2 Q16236 1/20 0.44
MAPK1 P28482 2/20 0.43
APAF1 O14727 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
SCHEMBL24848568 0.75 KDM4E (0.57) KDM4EHSD17B10MAPTPOLBTP53
SCHEMBL9773340 0.72 PTPN2 (0.46) KDM4EHSD17B10MAPTPOLBLMNA
SCHEMBL2056931 0.70 ALDH1A1 (0.72) KDM4EHSD17B10MAPTTP53LMNA
SCHEMBL29670121 0.70 ALDH1A1 (0.72) KDM4EHSD17B10MAPTTP53LMNA
SCHEMBL2783065 0.69 ALDH1A1 (0.59) KDM4EMAPTPOLBTP53LMNA
SCHEMBL29724622 0.69 ALDH1A1 (0.59) KDM4EMAPTPOLBTP53LMNA
SCHEMBL24848565 0.69 MAPT (0.53) KDM4EHSD17B10MAPTPOLBTP53
SCHEMBL29860539 0.67 ALDH1A1 (1.00) KDM4EHSD17B10MAPTALDH1A1SMN1; SMN2
SCHEMBL351486 0.67 ALDH1A1 (1.00) KDM4EHSD17B10MAPTALDH1A1SMN1; SMN2
SCHEMBL1312896 0.67 CSNK2A2 (0.55) KDM4EHSD17B10MAPTALDH1A1SMN1; SMN2

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
WO-1992022552-A1 IMIDAZO[1,5-a]QUINOXALINES THE UPJOHN COMPANY (US) 1992-12-23 WO claimed