SCHEMBL17685247

SCHEMBL17685247

Cc1ccc(-n2nc(C(C)(C)C)cc2NC(=O)Nc2ccc(Oc3ccnc(NC(=O)ON4CCCC4)c3)c3ccccc23)cc1

nearest known ligand 0.79

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 15/20 0.79
MAPK12 P53778 13/20 0.79
HCK P08631 11/20 0.74
SRC P12931 8/20 0.74
GSK3A P49840 4/20 0.74
SYK P43405 4/20 0.74
GSK3B P49841 2/20 0.74
BRAF P15056 2/20 0.62

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
SCHEMBL17685289 0.99 MAPK14 (0.78) MAPK14MAPK12HCKSRCGSK3A
SCHEMBL17685263 0.94 MAPK14 (0.77) MAPK14MAPK12HCKSRCGSK3A
SCHEMBL17685100 0.94 MAPK14 (0.76) MAPK14MAPK12HCKSRCGSK3A
SCHEMBL12540769 0.90 MAPK14 (0.81) MAPK14MAPK12HCKSRCGSK3A
SCHEMBL16290179 0.90 MAPK14 (0.63) MAPK14MAPK12HCKSRCGSK3A
SCHEMBL12542281 0.90 MAPK14 (0.80) MAPK14MAPK12HCKSRCGSK3A
SCHEMBL17685081 0.89 MAPK14 (0.71) MAPK14MAPK12HCKSRCGSK3A
SCHEMBL2568987 0.88 MAPK14 (1.00) MAPK14MAPK12HCKSRCGSK3A
SCHEMBL17685180 0.88 MAPK14 (0.72) MAPK14MAPK12HCKSRCGSK3A
SCHEMBL1694192 0.88 MAPK14 (0.87) MAPK14MAPK12HCKSRCGSK3A

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-2370429-B1 P38 MAP KINASE INHIBITORS RESPIVERT LTD (GB) 2016-04-20 EP claimed