SCHEMBL22418463

SCHEMBL22418463

Cn1cc(-c2ccc(OC(=O)NC(C)(C)C)cc2)c2c(N)ncnc21

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ FLT3 P36888 1/20 0.52
▸ TEK Q02763 11/20 0.50
▸ KDR P35968 11/20 0.50
▸ LCK P06239 10/20 0.50
▸ MET P08581 3/20 0.48
▸ AXL P30530 2/20 0.48
▸ SRC P12931 7/20 0.48
▸ RIPK2 O43353 2/20 0.47
▸ ABL1 P00519 1/20 0.44
▸ EGFR P00533 1/20 0.44
▸ ABL2 P42684 1/20 0.44

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
SCHEMBL22418477 0.84 TEK (0.52) FLT3TEKKDRLCKMET
SCHEMBL22418414 0.83 BTK (0.55) TEKLCKSRCRIPK2
SCHEMBL22418461 0.79 FLT3 (0.62) FLT3LCKMETAXLSRC
SCHEMBL22676745 0.78 SRC (0.67) TEKKDRLCKSRCRIPK2
SCHEMBL29407781 0.78 SRC (0.55) FLT3TEKKDRLCKMET
SCHEMBL22677981 0.78 SRC (0.55) FLT3TEKKDRLCKMET
SCHEMBL23917434 0.75 SRC (0.61) FLT3TEKKDRLCKMET
SCHEMBL18044717 0.75 KDR (0.59) FLT3TEKKDRLCKMET
SCHEMBL7005521 0.75 LCK (0.72) FLT3TEKKDRLCKAXL
SCHEMBL30582619 0.75 SRC (0.57) TEKKDRLCKSRCRIPK2

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-2020182188-A1 SUBSTITUTED HETEROARYL COMPOUND, COMPOSITION OF SAME, AND USES THEREOF 习峰 2020-09-17 — — WO disclosed
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