SCHEMBL5221091

SCHEMBL5221091

Cc1nnc(-c2ccc(-c3cc(OC(=O)Nc4cccc(N5CCOCC5)c4)ccc3C)cc2)o1

nearest known ligand 0.64

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 17/20 0.64
LCK P06239 3/20 0.64
MAP2K1 Q02750 2/20 0.64
CSF1R P07333 1/20 0.64
KDR P35968 1/20 0.64
SETD2 Q9BYW2 2/20 0.44
DGAT1 O75907 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
SCHEMBL14078303 0.85 MAPK14 (0.86) MAPK14LCKMAP2K1CSF1RKDR
SCHEMBL5124614 0.78 MAPK14 (1.00) MAPK14LCKMAP2K1CSF1RKDR
SCHEMBL14463562 0.78 MAPK14 (0.77) MAPK14LCKMAP2K1CSF1RKDR
SCHEMBL16986718 0.78 MAPT (0.55)
SCHEMBL16986717 0.77 GAA (0.58) LCKKDR
SCHEMBL16986673 0.76 MAPT (0.50) MAPK14
SCHEMBL6487595 0.75 MAPK14 (1.00) MAPK14LCKMAP2K1CSF1RKDR
SCHEMBL5216405 0.73 MAPK14 (0.57) MAPK14MAP2K1
SCHEMBL5224749 0.73 MAPK14 (0.53) MAPK14LCKMAP2K1CSF1R
SCHEMBL5220199 0.72 MAPK14 (0.50) MAPK14MAP2K1

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