SCHEMBL29928149

SCHEMBL29928149

Nc1nc(Nc2ccc(OCCN3CCCC3)cc2)nn1-c1ncnc2sc3c(c12)CCCC3

nearest known ligand 0.98

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AXL P30530 16/20 0.98
INSR P06213 7/20 0.70
BACE1 P56817 9/20 0.58

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
SCHEMBL4986525 1.00 AXL (0.98) AXLINSRBACE1
SCHEMBL4996172 0.99 AXL (1.00) AXLINSRBACE1
SCHEMBL29928467 0.98 AXL (0.95) AXLINSRBACE1
SCHEMBL4989956 0.98 AXL (0.95) AXLINSRBACE1
SCHEMBL4996620 0.89 AXL (1.00) AXLINSRBACE1
SCHEMBL4997728 0.88 AXL (0.77) AXLINSRBACE1
SCHEMBL4989878 0.88 AXL (0.77) AXLINSRBACE1
SCHEMBL4997637 0.87 AXL (1.00) AXLINSRBACE1
SCHEMBL29928975 0.87 AXL (1.00) AXLINSRBACE1
SCHEMBL929979 0.83 AXL (0.95) AXLINSRBACE1

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