SCHEMBL10288482

SCHEMBL10288482

Cc1cc(CN=O)ncc1-c1ccc2cc(NC(=O)C3CC3)ncc2c1

nearest known ligand 0.81

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 20/20 0.81

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
SCHEMBL10287937 0.92 ABL1 (0.81) ABL1
SCHEMBL10287729 0.90 ABL1 (1.00) ABL1
SCHEMBL10288286 0.90 ABL1 (0.85) ABL1
SCHEMBL10287717 0.88 ABL1 (0.81) ABL1
SCHEMBL14297832 0.88 ABL1 (0.85) ABL1
SCHEMBL9939547 0.86 ABL1 (0.82) ABL1
SCHEMBL18899748 0.86 ABL1 (0.79) ABL1
SCHEMBL14297759 0.86 ABL1 (1.00) ABL1
SCHEMBL10287763 0.85 ABL1 (0.66) ABL1
SCHEMBL9939366 0.85 ABL1 (0.85) ABL1

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-2012080284-A2 SUBSTITUTED 6,6-FUSED NITROGENOUS HETEROCYCLIC COMPOUNDS AND USES THEREOF F. HOFFMANN-LA ROCHE AG (CH) 2012-06-21 WO disclosed