SCHEMBL28911435

SCHEMBL28911435

C=CC(=O)N1CCC(c2nc(I)c3c(N)nccn23)C1

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ FGFR4 P22455 7/20 0.62
▸ FGFR1 P11362 5/20 0.62
▸ FGFR2 P21802 2/20 0.56
▸ FGFR3 P22607 3/20 0.46
▸ EGFR P00533 1/20 0.45
▸ JAK2 O60674 1/20 0.45
▸ JAK3 P52333 1/20 0.45
▸ BTK Q06187 6/20 0.45
▸ TNK2 Q07912 2/20 0.42

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
SCHEMBL24251869 1.00 FGFR4 (0.62) FGFR4FGFR1FGFR2FGFR3EGFR
SCHEMBL28911445 0.87 FGFR4 (0.49) FGFR4FGFR1FGFR2FGFR3BTK
SCHEMBL28911444 0.87 FGFR4 (0.49) FGFR4FGFR1FGFR2FGFR3BTK
SCHEMBL2574101 0.82 TNK2 (0.48) FGFR4FGFR1FGFR2FGFR3BTK
SCHEMBL26820282 0.81 TNK2 (0.59) FGFR4FGFR1FGFR2FGFR3BTK
SCHEMBL26791421 0.81 TNK2 (0.59) FGFR4FGFR1FGFR2FGFR3BTK
SCHEMBL29388063 0.80 FGFR4 (0.41) FGFR4FGFR1FGFR2FGFR3TNK2
SCHEMBL30101135 0.80 FGFR4 (0.58) FGFR4FGFR1FGFR2EGFRBTK
SCHEMBL30515956 0.78 FGFR4 (0.72) FGFR4FGFR1FGFR2FGFR3BTK
SCHEMBL30101111 0.78 TNK2 (0.61) FGFR4FGFR1FGFR2BTKTNK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115485281-B FGFR and mutation inhibitor thereof, and preparation method and application thereof 上海和誉生物医药科技有限公司 2023-11-21 — — CN disclosed
CN-115485281-A FGFR and mutation inhibitor thereof, and preparation method and application thereof 上海和誉生物医药科技有限公司 2022-12-16 — — CN disclosed
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