SCHEMBL30739372

SCHEMBL30739372

COc1cccnc1-c1cc2ncnc(N)c2n1-c1ccc(Oc2cccc(C)n2)c(F)c1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 5/20 0.40
PDE4B Q07343 1/20 0.36
PDE4D Q08499 1/20 0.36
TNK2 Q07912 5/20 0.34
TGFBR1 P36897 3/20 0.34
ALOX5AP P20292 1/20 0.33
TRPA1 O75762 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
PIK3CD O00329 1/20 0.32
DCK P27707 1/20 0.32
HCRTR1 O43613 1/20 0.32
HCRTR2 O43614 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
SCHEMBL30739402 0.89 MAP4K4 (0.37) MAP4K4PDE4BPDE4DTNK2TRPA1
SCHEMBL30739323 0.88 MAP4K4 (0.36) MAP4K4PDE4BPDE4DTNK2TRPA1
SCHEMBL30739376 0.83 BRD4 (0.40)
SCHEMBL30739393 0.80 MAP4K4 (0.32) MAP4K4L3MBTL1PIK3CD
SCHEMBL30739427 0.77 BRD4 (0.42)
SCHEMBL30739237 0.77 BLK (0.39) MAP4K4
SCHEMBL30739280 0.76 KMT2A (0.39) L3MBTL1
SCHEMBL30739145 0.75 TEK (0.37) MAP4K4
SCHEMBL30739425 0.70 CYP3A4 (0.38) MAP4K4PDE4BPDE4DTNK2PIK3CD
SCHEMBL30739301 0.65 MAP4K4 (0.42) MAP4K4

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