SCHEMBL3529181

SCHEMBL3529181

Cc1ccc(C(=O)NC2CC2)cc1-c1ccc2c(C(C)C(=O)O)noc2c1

nearest known ligand 0.71

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 18/20 0.71
MAPK13 O15264 2/20 0.65
KIT P10721 7/20 0.54
KDR P35968 6/20 0.54
LCK P06239 5/20 0.54
MAPK9 P45984 5/20 0.53
CSF1R P07333 1/20 0.51
MAPK10 P53779 2/20 0.50
LYN P07948 1/20 0.49

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
SCHEMBL3525957 0.85 MAPK14 (0.84) MAPK14MAPK13KITKDRLCK
SCHEMBL3523996 0.83 MAPK14 (1.00) MAPK14MAPK13KITKDRLCK
SCHEMBL3526283 0.82 MAPK14 (0.72) MAPK14MAPK13KITKDRLCK
SCHEMBL3526077 0.81 MAPK14 (0.74) MAPK14MAPK13KITKDRLCK
SCHEMBL3525332 0.79 MAPK14 (0.70) MAPK14MAPK13KITKDRLCK
SCHEMBL13546255 0.79 MAPK14 (0.70) MAPK14MAPK13KITKDRLCK
SCHEMBL3522859 0.79 MAPK14 (1.00) MAPK14MAPK13KITKDRLCK
SCHEMBL3523868 0.78 MAPK14 (0.67) MAPK14MAPK13KITKDRLCK
SCHEMBL3525660 0.78 MAPK13 (0.85) MAPK14MAPK13KITKDRLCK
SCHEMBL3524620 0.77 MAPK13 (0.83) MAPK14MAPK13KITKDRLCK

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-7642276-B2 Fused heteroaryl derivatives for use as P38 kinase inhibitors SMITHKLINE BEECHAM CORPORATION (US) 2010-01-05 US claimed