SCHEMBL6824985

SCHEMBL6824985

CCNC(=O)Nc1cc(Br)ccc1Nc1ccc(C(=O)c2cccc(Cl)c2C)c(Cl)c1

nearest known ligand 0.65

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPK13 O15264 10/20 0.65
MAPK12 P53778 10/20 0.65
MAPK11 Q15759 10/20 0.65
MAPK14 Q16539 10/20 0.65
MAPK1 P28482 1/20 0.40
MAPT P10636 1/20 0.40
F7 P08709 1/20 0.40
TP53 P04637 1/20 0.39
HTT P42858 2/20 0.39
JAK2 O60674 1/20 0.38
JAK1 P23458 1/20 0.38
TYK2 P29597 1/20 0.38
LMNA P02545 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38

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
SCHEMBL6824188 0.94 MAPK14 (0.69) MAPK13MAPK12MAPK11MAPK14MAPK1
SCHEMBL6824376 0.90 MAPK14 (0.81) MAPK13MAPK12MAPK11MAPK14MAPK1
SCHEMBL6903370 0.88 MAPK14 (0.59) MAPK13MAPK12MAPK11MAPK14MAPK1
SCHEMBL7647816 0.87 MAPK13 (0.62) MAPK13MAPK12MAPK11MAPK14MAPK1
SCHEMBL6825252 0.87 MAPK13 (0.64) MAPK13MAPK12MAPK11MAPK14MAPK1
SCHEMBL6826625 0.86 MAPK13 (0.66) MAPK13MAPK12MAPK11MAPK14MAPT
SCHEMBL6824811 0.85 MAPK13 (0.65) MAPK13MAPK12MAPK11MAPK14MAPT
SCHEMBL6817151 0.84 MAPK1 (0.61) MAPK13MAPK12MAPK11MAPK14MAPK1
SCHEMBL6825009 0.84 MAPK13 (0.64) MAPK13MAPK12MAPK11MAPK14MAPT
SCHEMBL6817149 0.84 MAPK1 (0.61) MAPK13MAPK12MAPK11MAPK14MAPK1

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-1210325-B1 AMINOBENZOPHENONES AS INHIBITORS OF IL-1BETA AND TNF-ALPHA LEO PHARMA AS (DK) 2004-10-06 EP disclosed
US-6750253-B1 INHIBITION OR DOWN REGULATION OF THE CYTOKINES IS POSSIBLY DUE TO AN INHIBITION OF MAP KINASES LEO PHARMACEUTICAL PRODUCTS LTD. A/S (DK) 2004-06-15 US disclosed
EP-1210325-A1 AMINOBENZOPHENONES AS INHIBITORS OF IL-1BETA AND TNF-ALPHA LEO PHARMACEUTICAL PRODUCTS LTD. A/S (LOVENS KEMISKE FABRIK PRODUKTIONSAKTIESELSKAB) (DK) 2002-06-05 EP disclosed
WO-2001005751-A1 AMINOBENZOPHENONES AS INHIBITORS OF IL-1β AND TNF-$g(a) Leo Pharmaceutical Products Ltd. A/S (Løvens Kemiske Fabrik Produktionsaktieselskab) (DK) 2001-01-25 WO disclosed