SCHEMBL6654823

SCHEMBL6654823

Nc1ccccc1Nc1ccc(C(=O)c2ccccc2)c(Cl)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 16/20 1.00
MAPK13 O15264 15/20 1.00
MAPK12 P53778 15/20 1.00
MAPK11 Q15759 15/20 1.00
GRM4 Q14833 1/20 0.50
GAA P10253 1/20 0.47
MAPT P10636 1/20 0.47

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
SCHEMBL6652639 0.92 MAPK14 (0.85) MAPK14MAPK13MAPK12MAPK11
SCHEMBL27529702 0.87 MAPK14 (0.78) MAPK14MAPK13MAPK12MAPK11GRM4
SCHEMBL6659531 0.87 MAPK14 (0.77) MAPK14MAPK13MAPK12MAPK11MAPT
SCHEMBL5989531 0.86 MAPK14 (0.78) MAPK14MAPK13MAPK12MAPK11GAA
SCHEMBL7191939 0.85 MAPK14 (0.74) MAPK14MAPK13MAPK12MAPK11MAPT
SCHEMBL27480922 0.85 MAPK13 (0.74) MAPK14MAPK13MAPK12MAPK11GAA
SCHEMBL7196435 0.84 MAPK14 (0.76) MAPK14MAPK13MAPK12MAPK11
SCHEMBL27482085 0.84 MAPK13 (0.72) MAPK14MAPK13MAPK12MAPK11GAA
SCHEMBL6655143 0.83 MAPK14 (0.71) MAPK14MAPK13MAPK12MAPK11GAA
SCHEMBL7199535 0.83 MAPK14 (0.74) MAPK14MAPK13MAPK12MAPK11GRM4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2013086002-A1 COMPOSITIONS, PROCESS OF PREPARATION OF SAID COMPOSITIONS AND METHOD OF TREATING CANCER CELLWORKS RESEARCH INDIA PRIVATE LIMITED (IN) 2013-06-13 WO disclosed
WO-2013086002-A1 COMPOSITIONS, PROCESS OF PREPARATION OF SAID COMPOSITIONS AND METHOD OF TREATING CANCER CELLWORKS RESEARCH INDIA PRIVATE LIMITED (IN) 2013-06-13 WO disclosed
CN-1188388-C Aminobenzophenones as inhibitors of interleukin and TNF LEO PHARM PROD LTD (DK) 2005-02-09 CN disclosed
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