SCHEMBL5347113

SCHEMBL5347113

O=C(C(=O)N1CCC1)c1c[nH]c2cc(Cl)c(C(=O)N3CCC(Cc4ccc(F)cc4)CC3)cc12

nearest known ligand 0.77

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 4/20 0.77

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
SCHEMBL21133899 0.93 MAPK14 (0.75) MAPK14
SCHEMBL5202123 0.92 MAPK14 (0.76) MAPK14
SCHEMBL5350273 0.92 MAPK14 (0.73) MAPK14
SCHEMBL5352532 0.87 MAPK14 (1.00) MAPK14
SCHEMBL4499746 0.85 MAPK14 (0.79) MAPK14
SCHEMBL5360018 0.85 MAPK14 (0.84) MAPK14
SCHEMBL5201196 0.85 MAPK14 (0.78) MAPK14
SCHEMBL5364410 0.84 MAPK14 (0.85) MAPK14
SCHEMBL14357732 0.84 MAPK14 (0.57) MAPK14
SCHEMBL14270492 0.83 MAPK14 (0.63) MAPK14

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
US-7238712-B2 Indole-type derivatives as inhibitors of p38 kinase SCIOS, INC. (US) 2007-07-03 US claimed