SCHEMBL6604940

SCHEMBL6604940

Cc1nnc(-c2ccc(C)c(-c3ccc(C(=O)NCc4ccco4)cc3)c2)o1

nearest known ligand 0.73

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 15/20 0.73
MAPK11 Q15759 2/20 0.66
ALDH1A1 P00352 3/20 0.58
HPGD P15428 1/20 0.58
TSHR P16473 1/20 0.58
MAPK1 P28482 1/20 0.58
RECQL P46063 1/20 0.58
TDP1 Q9NUW8 1/20 0.55
POLB P06746 1/20 0.51
MAPT P10636 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
SCHEMBL4863522 0.85 MAPK14 (1.00) MAPK14MAPK11
SCHEMBL4860372 0.84 MAPK14 (0.79) MAPK14MAPK11ALDH1A1HPGD
SCHEMBL4855124 0.82 MAPK14 (0.85) MAPK14MAPK11
SCHEMBL6606467 0.82 MAPK14 (0.68) MAPK14MAPK11
SCHEMBL6601878 0.82 MAPK14 (0.73) MAPK14MAPK11HPGD
SCHEMBL4862300 0.82 MAPK14 (0.83) MAPK14MAPK11POLB
SCHEMBL6605924 0.82 MAPK14 (0.83) MAPK14MAPK11
SCHEMBL4858295 0.82 MAPK14 (0.83) MAPK14MAPK11
SCHEMBL4856613 0.82 MAPK14 (0.83) MAPK14MAPK11
SCHEMBL4855057 0.81 MAPK14 (0.75) MAPK14MAPK11

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
EP-1436269-A1 OXADIAZOLYL-BIPHENYLCARBOXAMIDES AND THEIR USE AS P38 KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2004-07-14 EP disclosed
WO-2003033482-A1 OXADIAZOLYL-BIPHENYLCARBOXAMIDES AND THEIR USE AS P38 KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2003-04-24 WO disclosed