SCHEMBL18134032

SCHEMBL18134032

CCN1CCN(c2cc(C)c(Nc3ncc(C#Cc4c(F)c(OC)cc(OC)c4F)cn3)c(N)c2)CC1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ FGFR1 P11362 9/20 0.52
▸ FGFR4 P22455 8/20 0.52
▸ CHEK1 O14757 2/20 0.39
▸ GAA P10253 1/20 0.37
▸ RAD52 P43351 1/20 0.37
▸ PDGFRB P09619 2/20 0.36
▸ PDGFRA P16234 2/20 0.36
▸ FGFR3 P22607 5/20 0.35
▸ FGFR2 P21802 3/20 0.35
▸ MAPT P10636 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ MTOR P42345 2/20 0.34
▸ PIK3CA P42336 1/20 0.34

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
SCHEMBL18134024 0.88 FGFR1 (0.39) FGFR1FGFR4MTORPIK3CA
SCHEMBL18131808 0.87 FGFR4 (0.51) FGFR1FGFR4CHEK1GAAPDGFRB
SCHEMBL18134162 0.84 FGFR4 (0.71) FGFR1FGFR4FGFR3FGFR2
SCHEMBL18131815 0.84 FGFR4 (0.75) FGFR1FGFR4FGFR3FGFR2
SCHEMBL18134167 0.81 FGFR4 (0.67) FGFR1FGFR4FGFR3FGFR2
SCHEMBL21386624 0.78 FGFR1 (0.48) FGFR1FGFR4GAARAD52PDGFRB
SCHEMBL21756489 0.77 FGFR4 (0.47) FGFR1FGFR4GAARAD52PDGFRB
SCHEMBL18134023 0.76 FGFR4 (0.51) FGFR1FGFR4FGFR3FGFR2
SCHEMBL30262070 0.75 FGFR4 (0.46) FGFR1FGFR4PDGFRBPDGFRAFGFR3
SCHEMBL18131708 0.75 MAPT (0.39) FGFR1FGFR4MAPTMAPK1PIK3CA

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
WO-2016164703-A1 FGFR4 INHIBITORS EISAI R & D MANAGEMENT CO., LTD. (JP) 2016-10-13 — — WO disclosed
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