SCHEMBL20036729

SCHEMBL20036729

CCCCc1cc(NC(=O)Nc2ccc(OCCc3ccnc(NC(=O)NC)c3)c3ccccc23)n(-c2ccc(C)cc2)n1

nearest known ligand 0.79

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 18/20 0.79
MAPK12 P53778 15/20 0.79
HCK P08631 14/20 0.79
TNF P01375 1/20 0.61
SRC P12931 2/20 0.59

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
SCHEMBL12287020 0.94 MAPK14 (0.78) MAPK14MAPK12HCKTNFSRC
SCHEMBL20036733 0.89 MAPK14 (0.72) MAPK14MAPK12HCKTNFSRC
SCHEMBL20060696 0.89 MAPK14 (0.65) MAPK14MAPK12HCKSRC
SCHEMBL2407936 0.88 MAPK14 (1.00) MAPK14MAPK12HCKTNFSRC
SCHEMBL14701111 0.87 MAPK14 (0.77) MAPK14MAPK12HCKTNFSRC
SCHEMBL20036765 0.87 MAPK14 (0.66) MAPK14MAPK12HCKTNFSRC
SCHEMBL19731993 0.86 MAPK14 (0.59) MAPK14MAPK12HCKTNFSRC
SCHEMBL20036726 0.86 MAPK14 (0.67) MAPK14MAPK12HCKTNFSRC
SCHEMBL20036749 0.85 MAPK14 (0.67) MAPK14MAPK12HCKTNFSRC
SCHEMBL20036739 0.85 MAPK14 (0.78) MAPK14MAPK12HCKSRC

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-2509595-B1 INHIBITORS OF HEMOPOIETIC CELL KINASE (P59-HCK) AND THEIR USE IN THE TREATMENT OF INFLUENZA INFECTION RESPIVERT LTD (GB) 2018-04-11 EP disclosed