SCHEMBL22677207

SCHEMBL22677207

Cn1c(-c2ccc(NC(=O)C(C)(C)C)cc2)c(-c2ccc(Oc3ccc(Cl)cn3)c(O)c2)c2c(N)ncnc21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FGFR1 P11362 2/20 0.47
▸ FGFR2 P21802 2/20 0.47
▸ FGFR4 P22455 2/20 0.47
▸ FGFR3 P22607 2/20 0.47
▸ CYP3A4 P08684 1/20 0.47
▸ CYP2D6 P10635 1/20 0.47
▸ CYP2C9 P11712 1/20 0.47
▸ CYP2C19 P33261 1/20 0.47
▸ JAK2 O60674 3/20 0.40
▸ PIK3CD O00329 3/20 0.36
▸ ABL1 P00519 3/20 0.36
▸ EGFR P00533 3/20 0.36
▸ HCK P08631 3/20 0.36
▸ SRC P12931 3/20 0.36
▸ PIK3CA P42336 3/20 0.36
▸ PIK3CB P42338 3/20 0.36
▸ MTOR P42345 3/20 0.36
▸ PIK3CG P48736 3/20 0.36
▸ EPHB4 P54760 3/20 0.36
▸ PRKDC P78527 3/20 0.36

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
SCHEMBL30303529 0.89 FGFR1 (0.60) FGFR1FGFR2FGFR4FGFR3CYP3A4
SCHEMBL22675744 0.89 FGFR1 (0.60) FGFR1FGFR2FGFR4FGFR3CYP3A4
SCHEMBL22676670 0.81 FGFR1 (0.63) FGFR1FGFR2FGFR4FGFR3CYP3A4
SCHEMBL30303651 0.81 FGFR1 (0.63) FGFR1FGFR2FGFR4FGFR3CYP3A4
SCHEMBL30303558 0.80 FGFR1 (0.64) FGFR1FGFR2FGFR4FGFR3CYP3A4
SCHEMBL22676681 0.80 FGFR1 (0.64) FGFR1FGFR2FGFR4FGFR3CYP3A4
SCHEMBL31264680 0.78 FGFR1 (0.60) FGFR1FGFR2FGFR4FGFR3CYP3A4
SCHEMBL22676672 0.78 FGFR1 (0.55) FGFR1FGFR2FGFR4FGFR3CYP3A4
SCHEMBL22675728 0.77 FGFR1 (0.56) FGFR1FGFR2FGFR4FGFR3CYP3A4
SCHEMBL30303595 0.77 FGFR1 (0.56) FGFR1FGFR2FGFR4FGFR3CYP3A4

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-2020231990-A1 FGFR INHIBITORS AND METHODS OF USE THEREOF RELAY THERAPEUTICS, INC. (US) 2020-11-19 — — WO disclosed
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