SCHEMBL22418477

SCHEMBL22418477

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

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ TEK Q02763 9/20 0.52
▸ LCK P06239 9/20 0.52
▸ KDR P35968 9/20 0.52
▸ MET P08581 3/20 0.51
▸ AXL P30530 2/20 0.51
▸ SRC P12931 7/20 0.50
▸ FLT3 P36888 1/20 0.50
▸ ABL1 P00519 2/20 0.49
▸ EGFR P00533 2/20 0.49
▸ ABL2 P42684 2/20 0.49
▸ RIPK2 O43353 2/20 0.47
▸ EIF2AK3 Q9NZJ5 1/20 0.46

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
SCHEMBL22418463 0.84 FLT3 (0.52) TEKLCKKDRMETAXL
SCHEMBL28772346 0.84 EIF2AK3 (0.44) METAXLSRCFLT3EGFR
SCHEMBL22676745 0.83 SRC (0.67) TEKLCKKDRSRCABL1
SCHEMBL28633632 0.82 EIF2AK3 (0.51) KDRSRCFLT3ABL1EGFR
SCHEMBL22677981 0.81 SRC (0.55) TEKLCKKDRMETAXL
SCHEMBL29407781 0.81 SRC (0.55) TEKLCKKDRMETAXL
SCHEMBL23917434 0.80 SRC (0.61) TEKLCKKDRMETAXL
SCHEMBL30442066 0.80 FLT3 (0.51) LCKMETAXLFLT3EIF2AK3
SCHEMBL18044717 0.80 KDR (0.59) TEKLCKKDRMETAXL
SCHEMBL7005521 0.80 LCK (0.72) TEKLCKKDRAXLSRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111689991-B Substituted heteroaryl compounds, compositions and uses thereof 习峰 2023-06-09 — — CN disclosed
CN-111689991-A Substituted heteroaryl compounds, compositions and uses thereof 习峰 2020-09-22 — — CN disclosed
WO-2020182188-A1 SUBSTITUTED HETEROARYL COMPOUND, COMPOSITION OF SAME, AND USES THEREOF 习峰 2020-09-17 — — WO disclosed
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