SCHEMBL30739308

SCHEMBL30739308

Cc1cccc(Oc2ccc(-n3c(-c4ccc(N)cc4)c(C#N)c4ncnc(N)c43)cc2F)n1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 4/20 0.36
KDM4E B2RXH2 2/20 0.34
ALDH1A1 P00352 2/20 0.34
HTT P42858 1/20 0.34
HSD17B10 Q99714 1/20 0.34
LRRK2 Q5S007 2/20 0.34
ALOX5AP P20292 2/20 0.33
FEN1 P39748 2/20 0.33
TNK2 Q07912 4/20 0.32
PIK3CD O00329 1/20 0.32
PIK3R1 P27986 1/20 0.32
PIK3CA P42336 1/20 0.32
PIK3CB P42338 1/20 0.32
PIK3CG P48736 1/20 0.32
MEN1 O00255 1/20 0.32
GLA P06280 1/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
GFER P55789 1/20 0.32
KMT2A Q03164 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
SCHEMBL30739425 0.85 CYP3A4 (0.38) MAP4K4TNK2PIK3CDCYP3A4CYP2D6
SCHEMBL30739135 0.80 JAK2 (0.38) MAP4K4PIK3CDCSF1R
SCHEMBL29178906 0.76 CYP3A4 (0.46) MAP4K4ALOX5APFEN1TNK2CYP3A4
SCHEMBL30739353 0.76 CYP3A4 (0.46) MAP4K4ALOX5APFEN1TNK2CYP3A4
SCHEMBL30739175 0.75 CYP3A4 (0.44) MAP4K4ALOX5APFEN1TNK2CYP3A4
SCHEMBL29178879 0.75 CYP3A4 (0.44) MAP4K4ALOX5APFEN1TNK2CYP3A4
SCHEMBL30739213 0.75 CYP3A4 (0.45) MAP4K4ALOX5APFEN1TNK2CYP3A4
SCHEMBL29178681 0.75 CYP3A4 (0.45) MAP4K4ALOX5APFEN1TNK2CYP3A4
SCHEMBL30739197 0.73 CYP3A4 (0.44) MAP4K4ALOX5APFEN1TNK2PIK3CD
SCHEMBL30739301 0.70 MAP4K4 (0.42) MAP4K4KDM4EHTTMEN1KMT2A

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
CN-117466897-A Highly selective FGFR2 inhibitors 深圳福沃药业有限公司 2024-01-30 CN disclosed