SCHEMBL6171833

SCHEMBL6171833

Cc1ccc(C(=O)NC2CC2)cc1-c1ccc2c(N3CCOCC3)onc2c1

nearest known ligand 0.65

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 15/20 0.65
KIT P10721 4/20 0.65
KDR P35968 4/20 0.65
MAPK9 P45984 3/20 0.65
LCK P06239 2/20 0.65
MAPK13 O15264 2/20 0.60
RIPK2 O43353 2/20 0.56
MAPK10 P53779 1/20 0.54
SGK1 O00141 1/20 0.54
RAF1 P04049 1/20 0.52
ABL1 P00519 1/20 0.50

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
SCHEMBL6168068 0.85 MAPK14 (0.59) MAPK14KITKDRMAPK9LCK
SCHEMBL6170038 0.85 MAPK13 (0.54) MAPK14KITKDRMAPK9LCK
SCHEMBL3525660 0.84 MAPK13 (0.85) MAPK14KITKDRMAPK9LCK
SCHEMBL6171249 0.82 MAPK14 (0.71) MAPK14KITKDRMAPK9LCK
SCHEMBL2945618 0.79 MAPK14 (1.00) MAPK14KITKDRMAPK9LCK
SCHEMBL3524612 0.78 MAPK14 (0.66) MAPK14KITKDRMAPK9LCK
SCHEMBL3527377 0.77 MAPK14 (0.65) MAPK14KITKDRMAPK9LCK
SCHEMBL6190571 0.77 MAPK14 (0.71) MAPK14KITKDRMAPK9LCK
SCHEMBL2956864 0.77 MAPK14 (0.95) MAPK14KITKDRMAPK9LCK
SCHEMBL3525957 0.76 MAPK14 (0.84) MAPK14KITKDRMAPK9LCK

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-1531812-A1 FUSED HETEROARYL DERIVATIVES FOR USE AS P38 KINASE INHIBITORS IN THE TREATMENT OF I.A. RHEUMATOID ARTHRISTIS SMITHKLINE BEECHAM CORPORATION (US) 2005-05-25 EP disclosed
WO-2004010995-A1 FUSED HETEROARYL DERIVATIVES FOR USE AS P38 KINASE INHIBITORS IN THE TREATMENT OF I.A. RHEUMATOID ARTHRISTIS SMITHKLINE BEECHAM CORPORATION (US) 2004-02-05 WO disclosed