SCHEMBL30739402

SCHEMBL30739402

COc1cc(Br)cnc1-c1cc2ncnc(N)c2n1-c1ccc(Oc2cccc(C)n2)c(F)c1

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 3/20 0.37
PIK3CD O00329 3/20 0.32
TNK2 Q07912 2/20 0.31
PDE4B Q07343 1/20 0.31
PDE4D Q08499 1/20 0.31
TRPA1 O75762 1/20 0.31
CSF1R P07333 1/20 0.31
PIK3CA P42336 1/20 0.30
PIK3CB P42338 1/20 0.30
PIK3CG P48736 1/20 0.30

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
SCHEMBL30739323 0.90 MAP4K4 (0.36) MAP4K4PIK3CDTNK2PDE4BPDE4D
SCHEMBL30739372 0.89 MAP4K4 (0.40) MAP4K4PIK3CDTNK2PDE4BPDE4D
SCHEMBL30739203 0.83 KMT2A (0.39)
SCHEMBL30739376 0.83 BRD4 (0.40)
SCHEMBL30739393 0.80 MAP4K4 (0.32) MAP4K4PIK3CD
SCHEMBL30739280 0.77 KMT2A (0.39)
SCHEMBL30739427 0.76 BRD4 (0.42)
SCHEMBL30739145 0.74 TEK (0.37) MAP4K4
SCHEMBL30739237 0.74 BLK (0.39) MAP4K4
SCHEMBL30366632 0.66 KDM4E (0.40) 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