SCHEMBL29928115

SCHEMBL29928115

COc1cc2ncnc(-n3nc(Nc4ccc(N5CCC(N6CCCCC6)CC5)c(F)c4)nc3N)c2cc1OC

nearest known ligand 0.89

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
AXL P30530 16/20 0.89
KDR P35968 8/20 0.89
INSR P06213 7/20 0.89
CCR4 P51679 3/20 0.53
GALR1 P47211 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
SCHEMBL4984043 1.00 AXL (0.89) AXLKDRINSRCCR4GALR1
SCHEMBL4243304 0.94 AXL (1.00) AXLKDRINSRCCR4
SCHEMBL4238608 0.87 AXL (0.79) AXLKDRINSR
SCHEMBL29927936 0.87 AXL (0.79) AXLKDRINSR
SCHEMBL4982458 0.87 AXL (0.68) AXLKDRINSRCCR4
SCHEMBL29928357 0.86 AXL (0.76) AXLKDRINSR
SCHEMBL4986670 0.86 AXL (0.76) AXLKDRINSR
SCHEMBL4254711 0.86 AXL (0.85) AXLKDRINSRCCR4
SCHEMBL4983688 0.86 AXL (0.66) AXLKDRINSRCCR4
SCHEMBL4985229 0.85 AXL (0.65) AXLKDRINSRCCR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110551105-B Substituted triazoles useful as AXL inhibitors 里格尔制药公司 2022-10-18 CN claimed
CN-110551105-B Substituted triazoles useful as AXL inhibitors 里格尔制药公司 2022-10-18 CN disclosed