SCHEMBL6652827

SCHEMBL6652827

Nc1ccccc1Nc1ccc(C(=O)c2ccc(C(F)(F)F)cc2)cc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK13 O15264 7/20 0.73
MAPK12 P53778 7/20 0.73
MAPK11 Q15759 7/20 0.73
MAPK14 Q16539 7/20 0.73
PTGS1 P23219 5/20 0.65
MAPT P10636 4/20 0.55
ALDH1A1 P00352 3/20 0.55
GAA P10253 3/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
RAB9A P51151 1/20 0.55
KDM4E B2RXH2 3/20 0.52
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
GFER P55789 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
EPHX2 P34913 1/20 0.50
TP53 P04637 1/20 0.50
APP P05067 1/20 0.50
HPGD P15428 1/20 0.50
ALOX15 P16050 1/20 0.50

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
SCHEMBL6654792 0.88 MAPK13 (0.68) MAPK13MAPK12MAPK11MAPK14PTGS1
SCHEMBL29824523 0.88 MAPT (0.68) MAPK13MAPK12MAPK11MAPK14PTGS1
SCHEMBL15875869 0.88 MAPT (0.68) MAPK13MAPK12MAPK11MAPK14PTGS1
SCHEMBL6656632 0.86 MAPK13 (0.73) MAPK13MAPK12MAPK11MAPK14PTGS1
SCHEMBL6657103 0.85 GAA (0.72) MAPK13MAPK12MAPK11MAPK14MAPT
SCHEMBL3978775 0.85 MAPK13 (1.00) MAPK13MAPK12MAPK11MAPK14MAPT
SCHEMBL6651517 0.84 MAPK13 (0.79) MAPK13MAPK12MAPK11MAPK14MAPT
SCHEMBL6654831 0.81 MAPK13 (0.85) MAPK13MAPK12MAPK11MAPK14MAPT
SCHEMBL6658275 0.81 MAPK13 (0.79) MAPK13MAPK12MAPK11MAPK14MAPT
SCHEMBL27497826 0.81 MAPK13 (0.91) MAPK13MAPK12MAPK11MAPK14MAPT

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-0966424-B1 AMINOBENZOPHENONES AS INHIBITORS OF INTERLEUKIN AND TNF LEO PHARMA AS (DK) 2004-06-23 EP disclosed
US-6313174-B1 FOR THERAPY AND PROPHYLAXIS OF ASTHMA, ALLERGY, RHEUMATOID ARTHRITIS, SPONDYLOARTHRITIS, GOUT, ATHEROSCLEROSIS, CHRONIC INFLAMMATORY BOWEL DISEASE, PROLIFERATIVE AND INFLAMMATORY SKIN DISORDERS Leo Pharmaceutical Products Ltd.A/S/ (Løvens kemiske Fabrik Produktionsaktieselskab) (DK) 2001-11-06 US disclosed
EP-0966424-A1 AMINOBENZOPHENONES AS INHIBITORS OF INTERLEUKIN AND TNF LEO PHARMACEUTICAL PRODUCTS LTD. A/S (LOVENS KEMISKE FABRIK PRODUKTIONSAKTIESELSKAB) (DK) 1999-12-29 EP disclosed
WO-1998032730-A1 AMINOBENZOPHENONES AS INHIBITORS OF INTERLEUKIN AND TNF Leo Pharmaceutical Products Ltd. A/S (Løvens Kemiske Fabrik Produktionsaktieselskab) (DK) 1998-07-30 WO disclosed