SCHEMBL30739262

SCHEMBL30739262

COc1ccc(CNc2ncnc3cc(-c4ccc(N)cc4)n(-c4ccc(Oc5nccc(C)n5)c(F)c4)c23)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
LMNA P02545 4/20 0.38
EGFR P00533 4/20 0.35
POLB P06746 1/20 0.35
NR2F2 P24468 1/20 0.35
HTT P42858 1/20 0.35
CYP3A4 P08684 2/20 0.35
CYP2D6 P10635 2/20 0.35
CYP2C9 P11712 2/20 0.35
CYP2C19 P33261 2/20 0.35
FGFR1 P11362 1/20 0.35
FGFR2 P21802 1/20 0.35
FGFR4 P22455 1/20 0.35
FGFR3 P22607 1/20 0.35
MAPT P10636 2/20 0.35
PI4KB Q9UBF8 4/20 0.34
TP53 P04637 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
CLK4 Q9HAZ1 2/20 0.34

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
SCHEMBL30739279 0.87 CYP3A4 (0.38) MEN1KMT2ALMNAEGFRPOLB
SCHEMBL30739174 0.81 CYP3A4 (0.37) MEN1KMT2ALMNAEGFRPOLB
SCHEMBL30739246 0.81 PDE5A (0.35) MEN1KMT2ALMNAEGFRPOLB
SCHEMBL30739341 0.81 ALOX5AP (0.38) MEN1KMT2ALMNAEGFRPOLB
SCHEMBL30739340 0.80 PDE5A (0.35) MEN1KMT2ALMNAEGFRPOLB
SCHEMBL29178672 0.80 PDE5A (0.39) MEN1KMT2ALMNAEGFRPOLB
SCHEMBL30739154 0.80 PDE5A (0.39) MEN1KMT2ALMNAEGFRPOLB
SCHEMBL30739280 0.79 KMT2A (0.39) MEN1KMT2ALMNAEGFRPOLB
SCHEMBL30739241 0.79 PDE5A (0.37) MEN1KMT2ALMNAEGFRPOLB
SCHEMBL30739281 0.79 LMNA (0.40) MEN1KMT2ALMNAEGFRPOLB

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