SCHEMBL6560187

SCHEMBL6560187

CC(C)(N)c1ccc(C(=O)Nc2ccnc3[nH]ccc23)cc1Cl

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 2/20 0.58
JAK1 P23458 2/20 0.58
TYK2 P29597 1/20 0.58
ROCK2 O75116 5/20 0.57
ROCK1 Q13464 3/20 0.57
CIT O14578 3/20 0.57
PRKD3 O94806 2/20 0.57
PRKACA P17612 2/20 0.57
PRKCQ Q04759 2/20 0.57
PRKCD Q05655 2/20 0.57
PKN2 Q16513 2/20 0.57
PRKD2 Q9BZL6 2/20 0.57
MAP4K4 O95819 1/20 0.57
PRKCB P05771 1/20 0.57
PRKCA P17252 1/20 0.57
CSNK2A2 P19784 1/20 0.57
MARK3 P27448 1/20 0.57
BMPR1A P36894 1/20 0.57
CSNK1A1 P48729 1/20 0.57
CLK1 P49759 1/20 0.57

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
SCHEMBL6559132 0.88 ROCK2 (0.58) JAK2JAK1TYK2ROCK2ROCK1
SCHEMBL6560273 0.87 ROCK2 (0.57) JAK2JAK1TYK2ROCK2ROCK1
SCHEMBL6558106 0.87 ROCK2 (0.57) JAK2JAK1TYK2ROCK2ROCK1
SCHEMBL6557863 0.86 ROCK2 (0.56) JAK2JAK1TYK2ROCK2ROCK1
SCHEMBL2771542 0.85 ROCK2 (0.69) JAK2JAK1TYK2ROCK2ROCK1
SCHEMBL6558134 0.85 DHPS (0.43) JAK2JAK1TYK2ROCK2ROCK1
SCHEMBL6559117 0.85 ROCK2 (0.54) JAK2JAK1TYK2ROCK2ROCK1
SCHEMBL6558063 0.81 CIT (0.69) JAK2JAK1TYK2ROCK2ROCK1
SCHEMBL5466123 0.76 CIT (0.79) JAK2JAK1TYK2ROCK2ROCK1
SCHEMBL5465469 0.75 ROCK2 (0.61) JAK2JAK1TYK2ROCK2ROCK1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1391454-B1 Substituted benzamide compounds with antihypertensive activity MITSUBISHI TANABE PHARMA CORP (JP) 2012-05-30 EP disclosed
EP-1391454-A1 Substituted benzamide compounds with antihypertensive activity Mitsubishi Pharma Corporation (JP) 2004-02-25 EP disclosed
EP-1195372-A1 N-heterocyclic substituted benzamide derivatives with antihypertensive activity Mitsubishi Pharma Corporation (JP) 2002-04-10 EP disclosed
US-6156766-A Benzamide compounds and pharmaceutical use thereof YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 2000-12-05 US disclosed
EP-0757038-A1 BENZAMIDE COMPOUND AND MEDICINAL USE THEREOF YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1997-02-05 EP disclosed