SCHEMBL4948990

SCHEMBL4948990

COc1c(C#N)cc(C(C)(C)C)cc1NC(=O)C(=O)c1ccc(-c2ccncc2)c2ccccc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 13/20 1.00
SCARB1 Q8WTV0 7/20 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
SCHEMBL4949066 0.90 MAPK14 (1.00) MAPK14SCARB1
SCHEMBL4952957 0.87 MAPK14 (0.83) MAPK14SCARB1
SCHEMBL4944578 0.86 MAPK14 (1.00) MAPK14SCARB1
SCHEMBL4943425 0.86 MAPK14 (0.82) MAPK14SCARB1
SCHEMBL4949559 0.84 MAPK14 (0.73) MAPK14SCARB1
SCHEMBL4956669 0.84 MAPK14 (0.75) MAPK14SCARB1
SCHEMBL12669850 0.82 MAPK14 (0.74) MAPK14SCARB1
SCHEMBL4948529 0.80 MAPK14 (0.82) MAPK14SCARB1
SCHEMBL4947294 0.77 MAPK14 (0.73) MAPK14SCARB1
SCHEMBL12669854 0.77 MAPK14 (0.67) MAPK14SCARB1

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-2008089034-A2 CYTOKINE INHIBITORS KEMIA, INC. (US) 2008-07-24 WO disclosed