SCHEMBL5220245

SCHEMBL5220245

Cc1nnc(-c2ccc(-c3cc(OC(=O)NCC4CC4)ccc3C)c(C)c2)o1

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 18/20 0.61
MAPK11 Q15759 2/20 0.61
MAP2K1 Q02750 3/20 0.57
LCK P06239 3/20 0.46
CSF1R P07333 2/20 0.46
KDR P35968 1/20 0.44

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
SCHEMBL5116940 0.83 MAPK14 (0.79) MAPK14MAPK11MAP2K1LCKCSF1R
SCHEMBL5217308 0.77 MAPK14 (0.48) MAPK14MAPK11MAP2K1LCKCSF1R
SCHEMBL5216405 0.77 MAPK14 (0.57) MAPK14MAPK11MAP2K1
SCHEMBL5464918 0.76 MAPK14 (1.00) MAPK14MAPK11
SCHEMBL5216080 0.74 MAPK14 (0.88) MAPK14MAPK11MAP2K1
SCHEMBL5118009 0.73 MAPK14 (1.00) MAPK14MAPK11MAP2K1LCKCSF1R
SCHEMBL5123466 0.71 MAPK14 (0.72) MAPK14MAPK11MAP2K1LCKCSF1R
SCHEMBL5220199 0.70 MAPK14 (0.50) MAPK14MAPK11MAP2K1
SCHEMBL14470498 0.69 RAB9A (0.47)
SCHEMBL14470490 0.69 POLB (0.43)

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-1499600-B1 HETEROARYL SUBSTITUTED BIPHENYL DERIVATIVES AS P38 KINASE INHIBITORS SMITHKLINE BEECHAM CORP (US) 2007-07-25 EP claimed