SCHEMBL4021656

SCHEMBL4021656

COC(=O)c1cccc(Cc2c(C(=O)O)n(-c3ccccc3)c3cc(Cl)ccc3c2=O)c1

nearest known ligand 0.77

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 20/20 0.77
MAPK9 P45984 5/20 0.77
MAPK10 P53779 2/20 0.64

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
SCHEMBL848608 0.95 MAPK8 (0.85) MAPK8MAPK9MAPK10
SCHEMBL879620 0.87 MAPK8 (1.00) MAPK8MAPK9MAPK10
SCHEMBL849020 0.86 MAPK8 (0.89) MAPK8MAPK9MAPK10
SCHEMBL848193 0.85 MAPK8 (0.85) MAPK8MAPK9MAPK10
SCHEMBL846988 0.85 MAPK8 (0.84) MAPK8MAPK9MAPK10
SCHEMBL848660 0.85 MAPK8 (0.87) MAPK8MAPK9MAPK10
SCHEMBL879639 0.82 MAPK8 (0.85) MAPK8MAPK9MAPK10
SCHEMBL879658 0.82 MAPK8 (0.81) MAPK8MAPK9MAPK10
SCHEMBL847906 0.81 MAPK8 (0.85) MAPK8MAPK9MAPK10
SCHEMBL859976 0.81 MAPK8 (0.80) MAPK8MAPK9MAPK10

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-2009015917-A2 DIHYDROQUINONE AND DIHYDRONAPHTHRIDINE INHIBITORS OF JNK F. HOFFMANN-LA ROCHE AG (CH) 2009-02-05 WO disclosed