SCHEMBL16868752

SCHEMBL16868752

Cc1csc(NC(=O)Cc2cccc3ncccc23)c1-c1ncn[nH]1.Cc1n[nH]c(-c2sccc2NC(=O)Cc2ccc3c(c2)OCCO3)n1

nearest known ligand 0.63

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAPK9 P45984 20/20 0.63
MAPK10 P53779 18/20 0.63
MAPK8 P45983 16/20 0.63
MAPK1 P28482 1/20 0.51

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
SCHEMBL16868753 0.83 MAPK9 (0.48) MAPK9MAPK10MAPK8MAPK1
SCHEMBL21216172 0.81 MAPK9 (0.47) MAPK9MAPK10MAPK8MAPK1
SCHEMBL3776306 0.79 MAPK9 (1.00) MAPK9MAPK10MAPK8MAPK1
SCHEMBL3778162 0.79 MAPK10 (0.72) MAPK9MAPK10MAPK8MAPK1
SCHEMBL3782459 0.79 MAPK9 (0.75) MAPK9MAPK10MAPK8MAPK1
SCHEMBL3783754 0.79 MAPK8 (0.75) MAPK9MAPK10MAPK8
SCHEMBL3781055 0.76 MAPK8 (1.00) MAPK9MAPK10MAPK8
SCHEMBL3777866 0.76 MAPK10 (1.00) MAPK9MAPK10MAPK8MAPK1
SCHEMBL3783257 0.71 MAPK9 (1.00) MAPK9MAPK10MAPK8MAPK1
SCHEMBL3783200 0.70 MAPK9 (1.00) MAPK9MAPK10MAPK8MAPK1

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
US-9073891-B2 Inhibitors of Jun N-terminal kinase IMAGO PHARMACEUTICALS, INC. (US) 2015-07-07 US claimed