SCHEMBL9939460

SCHEMBL9939460

Cc1ccc(NC(=O)O)cc1-c1ccc2cc(NC(=O)C3CC3)ncc2c1

nearest known ligand 0.86

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 20/20 0.86

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
SCHEMBL14244656 0.93 ABL1 (1.00) ABL1
SCHEMBL18899763 0.92 ABL1 (0.83) ABL1
SCHEMBL14244512 0.90 ABL1 (1.00) ABL1
SCHEMBL14245139 0.89 ABL1 (1.00) ABL1
SCHEMBL15627487 0.89 ABL1 (0.82) ABL1
SCHEMBL18899704 0.89 ABL1 (0.78) ABL1
SCHEMBL10287725 0.88 ABL1 (1.00) ABL1
SCHEMBL9939225 0.88 ABL1 (1.00) ABL1
SCHEMBL14246684 0.87 ABL1 (1.00) ABL1
SCHEMBL14244624 0.87 ABL1 (1.00) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2651899-A2 SUBSTITUTED 6,6-FUSED NITROGENOUS HETEROCYCLIC COMPOUNDS AND USES THEREOF F.HOFFMANN-LA ROCHE AG (CH) 2013-10-23 EP disclosed
WO-2012080284-A2 SUBSTITUTED 6,6-FUSED NITROGENOUS HETEROCYCLIC COMPOUNDS AND USES THEREOF F. HOFFMANN-LA ROCHE AG (CH) 2012-06-21 WO disclosed