SCHEMBL24316808

SCHEMBL24316808

COc1cc(Oc2ccc3ncc(C)c(=O)n3c2)cnc1O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.41
RXFP1 Q9HBX9 1/20 0.37
MAPT P10636 1/20 0.37
PIK3CA P42336 2/20 0.36
MTOR P42345 2/20 0.36
KDM4E B2RXH2 3/20 0.35
GLA P06280 1/20 0.35
GAA P10253 1/20 0.35
COMT P21964 1/20 0.34
RIPK2 O43353 2/20 0.34
THRB P10828 1/20 0.33
ALPG P10696 1/20 0.33
CSF1R P07333 1/20 0.32
FGFR1 P11362 1/20 0.32
PRMT5 O14744 1/20 0.32
WDR77 Q9BQA1 1/20 0.32
NPBWR1 P48145 1/20 0.32
MCHR1 Q99705 1/20 0.32
NPC1 O15118 1/20 0.32
TP53 P04637 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
SCHEMBL29539198 0.89 KDM4E (0.41) POLBRXFP1MAPTPIK3CAMTOR
SCHEMBL24316556 0.89 KDM4E (0.41) POLBRXFP1MAPTPIK3CAMTOR
SCHEMBL24316804 0.88 KDM4E (0.35) POLBRXFP1PIK3CAMTORKDM4E
SCHEMBL24316434 0.80 CSF1R (0.53) POLBRXFP1PIK3CAMTORKDM4E
SCHEMBL24316983 0.79 CSF1R (0.46) RXFP1PIK3CAMTORCSF1RMCHR1
SCHEMBL24316982 0.79 CSF1R (0.48) POLBRXFP1PIK3CAMTORKDM4E
SCHEMBL24316549 0.79 CSF1R (0.43) POLBRXFP1PIK3CAMTORKDM4E
SCHEMBL24316814 0.78 CSF1R (0.47) RXFP1MAPTPIK3CAMTORKDM4E
SCHEMBL24316797 0.78 KDM4E (0.38) POLBMAPTPIK3CAMTORKDM4E
SCHEMBL24316436 0.77 KDM4E (0.37) POLBRXFP1PIK3CAMTORKDM4E

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-2022057895-A1 HETEROAROMATIC COMPOUNDS AND USES THEREOF HUTCHISON MEDIPHARMA LIMITED (CN) 2022-03-24 WO disclosed