SCHEMBL28764402

SCHEMBL28764402

CC(C)(CC(=O)O)CN1Cc2ccc(-c3nc(Cl)ncc3Cl)cc2C1=O

nearest known ligand 0.56

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 20/20 0.56
▸ MAPK3 P27361 1/20 0.48

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
SCHEMBL28764334 0.91 MAPK1 (0.55) MAPK1MAPK3
SCHEMBL18765806 0.85 MAPK1 (0.67) MAPK1
SCHEMBL18765621 0.81 MAPK1 (0.70) MAPK1MAPK3
SCHEMBL29339313 0.80 MAPK1 (0.59) MAPK1
SCHEMBL18793713 0.79 MAPK1 (0.68) MAPK1
SCHEMBL18793927 0.79 MAPK1 (0.69) MAPK1MAPK3
SCHEMBL18765934 0.78 MAPK1 (0.58) MAPK1
SCHEMBL29338941 0.78 MAPK1 (0.52) MAPK1
SCHEMBL29338666 0.77 MAPK1 (0.57) MAPK1
SCHEMBL18765652 0.77 MAPK1 (0.68) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114948963-A Protein kinase inhibitor benzolactam compounds 大冢制药株式会社 2022-08-30 — — CN disclosed
CN-108617166-B Protein kinase inhibitor benzolactam compounds 大冢制药株式会社 2022-05-17 — — CN disclosed
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