SCHEMBL28098655

SCHEMBL28098655

COc1cc2c(N)ncnn2c1C=O

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE5A O76074 1/20 0.34
▸ FGFR1 P11362 5/20 0.33
▸ TNK2 Q07912 3/20 0.33
▸ S100B P04271 1/20 0.33
▸ FGFR3 P22607 3/20 0.33
▸ MTOR P42345 2/20 0.32
▸ RICTOR Q6R327 2/20 0.32
▸ RPTOR Q8N122 2/20 0.32
▸ MAPKAP1 Q9BPZ7 2/20 0.32
▸ MLST8 Q9BVC4 2/20 0.32
▸ PIK3CA P42336 2/20 0.32
▸ PIK3CG P48736 2/20 0.32
▸ RIPK2 O43353 1/20 0.32
▸ RET P07949 1/20 0.32
▸ NQO2 P16083 1/20 0.32
▸ CSNK2A2 P19784 1/20 0.32
▸ FECH P22830 1/20 0.32
▸ ACVR1B P36896 1/20 0.32
▸ TGFBR1 P36897 1/20 0.32
▸ MAPK10 P53779 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
SCHEMBL15019260 0.79 LMNA (0.34) FGFR1FGFR3KDM4EALDH1A1PIK3CD
SCHEMBL15023642 0.74 FGFR1 (0.35) FGFR1FGFR3
SCHEMBL15023612 0.73 TNIK (0.33) MAP4K4
SCHEMBL28098635 0.69 PLK4 (0.32) PDE5AFGFR1TNK2FGFR3PIK3CA
SCHEMBL279391 0.67 MAP4K4 (0.39) FGFR1FGFR3ACVRL1MAP4K4KDM4E
SCHEMBL27760000 0.66 FGFR1 (0.49) FGFR1FGFR3ACVRL1
SCHEMBL59543 0.65 MAP4K4 (0.41) MAP4K4
SCHEMBL25714863 0.65 MAP4K4 (0.41) TNK2CSNK2A2ACVRL1MAP4K4KDM4E
SCHEMBL22054780 0.65 FGFR1 (0.41) PDE5AFGFR1TNK2FGFR3ACVRL1
SCHEMBL15020389 0.63 FGFR1 (0.36) FGFR1FGFR3RETACVRL1PIK3CD

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-104245700-B Dibasic benzothienyl-pyrrolo-triazine and the purposes as FGFR inhibitors of kinases thereof 拜耳制药股份公司 2016-11-16 — — CN disclosed
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