SCHEMBL18793835

SCHEMBL18793835

CN(C(=O)C(CO)N1Cc2ccc(-c3nc(Cl)ncc3Cl)cc2C1=O)C(C)(C)C

nearest known ligand 0.72

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 20/20 0.72
▸ MAPK3 P27361 1/20 0.49

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
SCHEMBL20738678 0.89 MAPK1 (0.71) MAPK1MAPK3
SCHEMBL18766156 0.88 MAPK1 (0.60) MAPK1MAPK3
SCHEMBL18793321 0.86 MAPK1 (0.54) MAPK1
SCHEMBL20738628 0.85 MAPK1 (0.54) MAPK1
SCHEMBL18765648 0.84 MAPK1 (1.00) MAPK1MAPK3
SCHEMBL18765701 0.82 MAPK1 (0.53) MAPK1
SCHEMBL18765704 0.82 MAPK1 (0.53) MAPK1
SCHEMBL18794012 0.80 MAPK1 (0.49) MAPK1
SCHEMBL28764578 0.80 MAPK1 (0.49) MAPK1
SCHEMBL18766115 0.79 MAPK1 (0.49) MAPK1

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-2017068412-A1 BENZOLACTAM COMPOUNDS AS PROTEIN KINASE INHIBITORS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2017-04-27 — — WO disclosed
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