SCHEMBL6633832

SCHEMBL6633832

Cc1ccccc1C(=O)c1ccc(Nc2ccccc2CCN2C(=O)NC(C)C2=O)cc1Cl

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 15/20 0.58
MAPK13 O15264 14/20 0.58
MAPK12 P53778 14/20 0.58
MAPK11 Q15759 14/20 0.58
ATAD2 Q6PL18 1/20 0.35
CECR2 Q9BXF3 1/20 0.35
DDB1 Q16531 1/20 0.34
CRBN Q96SW2 1/20 0.34
SIRT2 Q8IXJ6 1/20 0.34
AVPR2 P30518 1/20 0.34
OXTR P30559 1/20 0.34
AVPR1A P37288 1/20 0.34
MAP2K2 P36507 1/20 0.33
MAP2K1 Q02750 1/20 0.33

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
SCHEMBL6094765 0.83 MAPK14 (0.61) MAPK14MAPK13MAPK12MAPK11
SCHEMBL6632888 0.82 MAPK14 (0.53) MAPK14MAPK13MAPK12MAPK11ATAD2
SCHEMBL6096253 0.82 MAPK14 (0.60) MAPK14MAPK13MAPK12MAPK11SIRT2
SCHEMBL6094353 0.81 MAPK14 (0.59) MAPK14MAPK13MAPK12MAPK11ATAD2
SCHEMBL6094197 0.80 MAPK14 (0.57) MAPK14MAPK13MAPK12MAPK11DDB1
SCHEMBL6093762 0.80 MAPK14 (0.74) MAPK14MAPK13MAPK12MAPK11SIRT2
SCHEMBL6096703 0.79 MAPK14 (0.63) MAPK14MAPK13MAPK12MAPK11
SCHEMBL5172447 0.79 MAPK14 (0.79) MAPK14MAPK13MAPK12MAPK11AVPR2
SCHEMBL6097137 0.78 MAPK14 (0.71) MAPK14MAPK13MAPK12MAPK11SIRT2
SCHEMBL6094908 0.78 MAPK14 (0.77) MAPK14MAPK13MAPK12MAPK11AVPR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1423356-A2 NOVEL AMINOBENZOEPHENONES Leo Pharma A/S (DK) 2004-06-02 EP claimed
WO-2003018535-A2 NOVEL AMINOBENZOEPHENONES LEO PHARMA A/S (DK) 2003-03-06 WO claimed
EP-1423356-A2 NOVEL AMINOBENZOEPHENONES Leo Pharma A/S (DK) 2004-06-02 EP disclosed
WO-2003018535-A2 NOVEL AMINOBENZOEPHENONES LEO PHARMA A/S (DK) 2003-03-06 WO disclosed