SCHEMBL24458664

SCHEMBL24458664

COCCN(C)C/C=C/C(=O)N1C[C@@H]2[C@@H](C#Cc3c(-c4ccc(Oc5ccccc5)cc4)c4c(N)ncnc4n3C)[C@@H]2C1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ FGFR2 P21802 4/20 0.52
▸ BTK Q06187 15/20 0.51
▸ EGFR P00533 6/20 0.51
▸ LCK P06239 6/20 0.48
▸ ITK Q08881 4/20 0.48
▸ KDR P35968 1/20 0.41
▸ TEK Q02763 1/20 0.41
▸ FGFR1 P11362 1/20 0.41
▸ FGFR4 P22455 1/20 0.41
▸ FGFR3 P22607 1/20 0.41

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
SCHEMBL31523733 1.00 FGFR2 (0.52) FGFR2BTKEGFRLCKITK
SCHEMBL24458963 0.93 FGFR2 (0.49) FGFR2BTKEGFRLCKITK
SCHEMBL31523878 0.93 FGFR2 (0.49) FGFR2BTKEGFRLCKITK
SCHEMBL24459135 0.91 BTK (0.58) FGFR2BTKEGFRLCKITK
SCHEMBL31523787 0.89 BTK (0.50) FGFR2BTKEGFRLCKITK
SCHEMBL24458671 0.89 BTK (0.50) FGFR2BTKEGFRLCKITK
SCHEMBL31523736 0.86 FGFR2 (0.49) FGFR2BTKEGFRLCKITK
SCHEMBL24458422 0.85 BTK (0.59) FGFR2BTKEGFRLCKITK
SCHEMBL24458719 0.84 BTK (0.51) FGFR2BTKEGFRLCKITK
SCHEMBL31523971 0.84 BTK (0.51) FGFR2BTKEGFRLCKITK

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-2022109551-A1 SRC INHIBITORS AND USES THEREOF RELAY THERAPEUTICS, INC. (US) 2022-05-27 — — WO disclosed
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