SCHEMBL6400247

SCHEMBL6400247

Cc1ccc(C)c(C(=O)c2ccc(Nc3ccc(Br)cc3NC(=O)OC3CCCC3)cc2Cl)c1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPK13 O15264 10/20 0.51
MAPK12 P53778 10/20 0.51
MAPK11 Q15759 10/20 0.51
MAPK14 Q16539 10/20 0.51
NPC1 O15118 6/20 0.41
RAB9A P51151 6/20 0.41
POLB P06746 1/20 0.41
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.36
HTT P42858 2/20 0.35
TSHR P16473 1/20 0.35
EPHX2 P34913 1/20 0.35

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
SCHEMBL6396062 0.92 MAPK13 (0.49) MAPK13MAPK12MAPK11MAPK14NPC1
SCHEMBL6394489 0.89 MAPK13 (0.51) MAPK13MAPK12MAPK11MAPK14NPC1
SCHEMBL6400902 0.89 MAPK13 (0.55) MAPK13MAPK12MAPK11MAPK14NPC1
SCHEMBL6395553 0.88 MAPK14 (0.54) MAPK13MAPK12MAPK11MAPK14NPC1
SCHEMBL6402341 0.87 MAPK13 (0.50) MAPK13MAPK12MAPK11MAPK14NPC1
SCHEMBL6906594 0.86 MAPK13 (0.59) MAPK13MAPK12MAPK11MAPK14NPC1
SCHEMBL6401565 0.85 MAPK13 (0.50) MAPK13MAPK12MAPK11MAPK14NPC1
SCHEMBL6398542 0.83 MAPK13 (0.47) MAPK13MAPK12MAPK11MAPK14NPC1
SCHEMBL2198762 0.82 MAPK13 (0.44) MAPK13MAPK12MAPK11MAPK14NPC1
SCHEMBL6905858 0.81 MAPK13 (0.54) MAPK13MAPK12MAPK11MAPK14NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6897236-B1 Aminobenzophenones as inhibitors of IL-1β and TNF-α LEO PHARMACEUTICAL PRODUCTS, LTD. (DK) 2005-05-24 US claimed
EP-1202959-B1 AMINOBENZOPHENONES AS INHIBITORS OF IL-1-BETA AND TNF-ALPHA LEO PHARMA AS (DK) 2004-09-29 EP claimed
US-6897236-B1 Aminobenzophenones as inhibitors of IL-1β and TNF-α LEO PHARMACEUTICAL PRODUCTS, LTD. (DK) 2005-05-24 US disclosed
EP-1202959-B1 AMINOBENZOPHENONES AS INHIBITORS OF IL-1-BETA AND TNF-ALPHA LEO PHARMA AS (DK) 2004-09-29 EP disclosed
EP-1202959-A1 AMINOBENZOPHENONES AS INHIBITORS OF IL-1-BETA AND TNF-ALPHA LEO PHARMACEUTICAL PRODUCTS LTD. A/S (LOVENS KEMISKE FABRIK PRODUKTIONSAKTIESELSKAB) (DK) 2002-05-08 EP disclosed
WO-2001005749-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