SCHEMBL25916657

SCHEMBL25916657

C=C(C)Nc1cc(CCc2cnc(NC(=O)Nc3cccc(C(C)(C)C)c3)s2)ccn1

nearest known ligand 0.87

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 20/20 0.87
MAPK13 O15264 2/20 0.53

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
SCHEMBL23201783 0.93 MAPK14 (1.00) MAPK14MAPK13
SCHEMBL29844609 0.93 MAPK14 (1.00) MAPK14MAPK13
SCHEMBL25916668 0.89 MAPK14 (0.85) MAPK14MAPK13
SCHEMBL23637688 0.88 MAPK14 (1.00) MAPK14MAPK13
SCHEMBL23201738 0.86 MAPK14 (0.77) MAPK14MAPK13
SCHEMBL23201735 0.84 MAPK14 (0.75) MAPK14MAPK13
SCHEMBL25641501 0.81 MAPK14 (0.86) MAPK14MAPK13
SCHEMBL29844465 0.78 MAPK14 (1.00) MAPK14MAPK13
SCHEMBL23201747 0.78 MAPK14 (1.00) MAPK14MAPK13
SCHEMBL23201781 0.75 MAPK14 (1.00) MAPK14MAPK13

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
EP-4219489-A2 MITOGEN-ACTIVATED PROTEIN KINASE INHIBITORS, METHODS OF MAKING, AND METHODS OF USE THEREOF Washington University (US) 2023-08-02 EP disclosed