SCHEMBL29928964

SCHEMBL29928964

Cc1cc(O)nc(-n2nc(Nc3ccc(OCCN4CCCC4)cc3)nc2N)n1

nearest known ligand 0.63

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AXL P30530 13/20 0.63
BACE1 P56817 13/20 0.62
INSR P06213 2/20 0.61

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
SCHEMBL3955515 1.00 AXL (0.63) AXLBACE1INSR
SCHEMBL4249916 0.83 AXL (0.80) AXLBACE1
SCHEMBL3963464 0.81 AXL (0.67) AXLBACE1INSR
SCHEMBL29929516 0.81 AXL (0.67) AXLBACE1INSR
SCHEMBL4233948 0.79 AXL (0.77) AXLBACE1INSR
SCHEMBL29928365 0.79 BACE1 (0.75) AXLBACE1INSR
SCHEMBL4775480 0.79 BACE1 (0.73) AXLBACE1INSR
SCHEMBL4241929 0.77 AXL (1.00) AXLBACE1INSR
SCHEMBL4991031 0.77 AXL (1.00) AXLBACE1
SCHEMBL29929245 0.77 AXL (1.00) AXLBACE1

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