SCHEMBL29590529

SCHEMBL29590529

Brc1ccc2nc(-c3cn[nH]c3)cnc2c1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 2/20 0.52
▸ FGFR1 P11362 13/20 0.44
▸ FGFR2 P21802 13/20 0.44
▸ FGFR3 P22607 13/20 0.44
▸ KDR P35968 12/20 0.44
▸ FGFR4 P22455 11/20 0.43
▸ FLT3 P36888 2/20 0.42
▸ TLR9 Q9NR96 1/20 0.41
▸ ILK Q13418 1/20 0.40
▸ ACVR1 Q04771 1/20 0.40
▸ AKT1 P31749 1/20 0.40
▸ AKT2 P31751 1/20 0.40

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
SCHEMBL27090893 1.00 MAPK1 (0.52) MAPK1FGFR1FGFR2FGFR3KDR
SCHEMBL2592957 0.94 MAPK1 (0.52) MAPK1FGFR1FGFR2FGFR3KDR
SCHEMBL29400331 0.82 TLR9 (0.63) MAPK1FGFR1FGFR2FGFR3KDR
SCHEMBL30646549 0.82 MAPK1 (0.52) MAPK1FGFR1FGFR2FGFR3KDR
SCHEMBL7600391 0.80 TLR9 (0.51) KDRFLT3TLR9
SCHEMBL29590784 0.79 MAPK1 (0.59) MAPK1FGFR1FGFR2FGFR3KDR
SCHEMBL5211835 0.79 MAPK1 (0.59) MAPK1FGFR1FGFR2FGFR3KDR
SCHEMBL5199018 0.78 TLR9 (0.66) MAPK1KDRFLT3TLR9
SCHEMBL12178898 0.76 TLR9 (0.55) MAPK1FGFR1FGFR2FGFR3KDR
SCHEMBL16642057 0.76 MAPK1 (0.52) MAPK1FGFR1FGFR2FGFR3KDR

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4225749-A1 COMPOUNDS AND METHODS OF TREATING CANCERS Cullgen (Shanghai), Inc. (CN) 2023-08-16 — — EP disclosed
CN-116583509-A Compounds and methods for treating cancer 上海睿跃生物科技有限公司 2023-08-11 — — CN disclosed
WO-2022073469-A1 COMPOUNDS AND METHODS OF TREATING CANCERS CULLGEN (SHANGHAI) , INC. (CN) 2022-04-14 — — WO disclosed
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