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SCHEMBL25916574

SCHEMBL25916574

CC(CC(C)(C)c1cccc(NC(=O)Nc2ncc(CCc3ccnc(NC(=O)C4CC4)c3)s2)c1)OC(=O)Nc1cc(CCc2cnc(NC(=O)Nc3cc(C(F)(F)F)ccc3F)s2)ccn1

nearest known ligand 0.64

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ MAPK14 Q16539 11/20 0.64
▸ KDR P35968 9/20 0.47
▸ BRAF P15056 5/20 0.47
▸ MAPK13 O15264 1/20 0.46

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
SCHEMBL23637688 0.79 MAPK14 (1.00) MAPK14MAPK13
SCHEMBL29844330 0.77 MAPK14 (0.62) MAPK14MAPK13
SCHEMBL23201730 0.77 MAPK14 (0.62) MAPK14MAPK13
SCHEMBL23201749 0.77 MAPK14 (0.71) MAPK14MAPK13
SCHEMBL29844523 0.77 MAPK14 (0.71) MAPK14MAPK13
SCHEMBL25641470 0.74 MAPK14 (0.64) MAPK14MAPK13
SCHEMBL25641471 0.73 MAPK14 (0.72) MAPK14MAPK13
SCHEMBL23637691 0.71 MAPK14 (1.00) MAPK14KDRBRAFMAPK13
SCHEMBL29844422 0.71 MAPK14 (1.00) MAPK14KDRBRAFMAPK13
SCHEMBL29844609 0.71 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