SCHEMBL7335282

SCHEMBL7335282

CC(C)C(NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)c1ccc(C(=O)N2CCOCC2)cc1)C(C)C)C(=O)C(F)(F)C(F)(F)F

nearest known ligand 0.91

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ELANE P08246 18/20 0.91
CTSG P08311 1/20 0.65
MALT1 Q9UDY8 1/20 0.51
CMA1 P23946 1/20 0.46

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
SCHEMBL29941605 1.00 ELANE (0.91) ELANECTSGMALT1CMA1
SCHEMBL7963859 0.97 ELANE (0.85) ELANECTSGMALT1CMA1
SCHEMBL7333552 0.95 ELANE (1.00) ELANECTSGMALT1CMA1
SCHEMBL7330574 0.94 ELANE (0.95) ELANECTSGMALT1CMA1
SCHEMBL7861402 0.93 ELANE (0.85) ELANECTSGMALT1CMA1
SCHEMBL7960491 0.91 ELANE (0.75) ELANECTSGMALT1
SCHEMBL7964086 0.90 ELANE (0.75) ELANECTSGMALT1CMA1
SCHEMBL7278891 0.87 ELANE (0.70) ELANECTSGMALT1
SCHEMBL6740115 0.87 ELANE (0.70) ELANECTSGMALT1
SCHEMBL7952500 0.87 ELANE (0.75) ELANECTSGCMA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0762887-B1 ACYLATED ENOL DERIVATIVES AS PRODRUGS OF ELASTASE INHIBITORS MERRELL PHARMA INC (US) 2001-09-26 EP disclosed
US-6265381-B1 MORPHOLINOUREA AND RELATED DERIVATIVES OF PENTAFLUOROETHYL PEPTIDES MERRELL PHARMACEUTICALS, INC. 2001-07-24 US disclosed
US-6172044-B1 ELASTASE INHIBITORS; ANTIINFLAMMATORY AGENTS; RESPIRATORY SYSTEM DISORDERS AVENTIS PHARMACEUTICALS INC. 2001-01-09 US disclosed
EP-0863915-B1 ACYLATED ENOL DERIVATIVES OF ALPHA-KETOESTERS AND ALPHA-KETOAMIDES HOECHST MARION ROUSSEL INC (US) 2000-02-02 EP disclosed
US-6008196-A AN ENZYME INHIBITORS OF HUMAN NEUTROPHIL ELASTASE HOECHST MARION ROUSSEL, INC. (US) 1999-12-28 US disclosed
US-5972897-A AN ANTIINFLAMMATORY AGENTS TREATING CYSTIC FIBROSIS AND EMPHYSEMA OR BOWEL DISEASES, A NEUTROPHIL ASSOCIATED INFLAMMATORY DISEASE, BRONCHITIS MERRELL PHARMACEUTICALS INC. (US) 1999-10-26 US disclosed
EP-0762887-A4 ACYLATED ENOL DERIVATIVES AS PRODRUGS OF ELASTASE INHIBITORS MERRELL PHARMA INC (US) 1999-03-31 EP disclosed
EP-0863915-A1 ACYLATED ENOL DERIVATIVES OF $g(a)-KETOESTERS AND $g(a)-KETOAMIDES HOECHST MARION ROUSSEL, INC. (US) 1998-09-16 EP disclosed
WO-1997020856-A1 ACYLATED ENOL DERIVATIVES OF α-KETOESTERS AND α-KETOAMIDES HOECHST MARION ROUSSEL, INC. (US) 1997-06-12 WO disclosed
EP-0763055-A1 PERFLUOROALKYL KETONE INHIBITORS OF ELASTASE AND PROCESSES FOR MAKING THE SAME MERRELL PHARMACEUTICALS INC. (US) 1997-03-19 EP disclosed
EP-0762887-A1 ACYLATED ENOL DERIVATIVES AS PRODRUGS OF ELASTASE INHIBITORS MERRELL PHARMACEUTICALS INC. (US) 1997-03-19 EP disclosed
WO-1995033762-A1 PERFLUOROALKYL KETONE INHIBITORS OF ELASTASE AND PROCESSES FOR MAKING THE SAME MERRELL PHARMACEUTICALS INC. (US) 1995-12-14 WO disclosed
WO-1995033478-A1 ACYLATED ENOL DERIVATIVES AS PRODRUGS OF ELASTASE INHIBITORS MERRELL PHARMACEUTICALS INC. (US) 1995-12-14 WO disclosed