SCHEMBL6652857

SCHEMBL6652857

Cc1cc(C(=O)c2ccccc2C)ccc1Nc1ccccc1N

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 13/20 1.00
MAPK13 O15264 12/20 1.00
MAPK12 P53778 12/20 1.00
MAPK11 Q15759 12/20 1.00
ALDH1A1 P00352 5/20 0.45
HTT P42858 1/20 0.45
KDM4E B2RXH2 1/20 0.44
GAA P10253 1/20 0.44
MAPT P10636 1/20 0.44
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
CYP1A2 P05177 1/20 0.43
HPGD P15428 1/20 0.43
HSD17B10 Q99714 1/20 0.43
HDAC3 O15379 1/20 0.41

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
SCHEMBL6659642 0.86 MAPK14 (0.76) MAPK14MAPK13MAPK12MAPK11ALDH1A1
SCHEMBL6653033 0.86 MAPK13 (0.76) MAPK14MAPK13MAPK12MAPK11ALDH1A1
SCHEMBL6657232 0.83 MAPK14 (1.00) MAPK14MAPK13MAPK12MAPK11ALDH1A1
SCHEMBL6651240 0.80 MAPK13 (0.66) MAPK14MAPK13MAPK12MAPK11ALDH1A1
SCHEMBL7195956 0.80 MAPK14 (1.00) MAPK14MAPK13MAPK12MAPK11GAA
SCHEMBL6651159 0.79 MAPK13 (0.65) MAPK14MAPK13MAPK12MAPK11ALDH1A1
SCHEMBL12792043 0.74 ALDH1A1 (0.74) MAPK14MAPK13MAPK12MAPK11ALDH1A1
SCHEMBL4943542 0.74 MAPT (0.59) MAPK14MAPK13MAPK12MAPK11ALDH1A1
SCHEMBL20077656 0.73 MAPK13 (0.66) MAPK14MAPK13MAPK12MAPK11ALDH1A1
SCHEMBL6354092 0.73 ALDH1A1 (0.68) MAPK14MAPK13MAPK12MAPK11ALDH1A1

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