SCHEMBL8498381

SCHEMBL8498381

CC(C)C(NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C)C(=O)C(F)(F)F

nearest known ligand 0.63

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ELANE P08246 7/20 0.63
CMA1 P23946 13/20 0.61

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
SCHEMBL7337411 0.92 ELANE (0.62) ELANECMA1
SCHEMBL8136651 0.90 ELANE (0.63) ELANECMA1
SCHEMBL7374559 0.90 ELANE (0.63) ELANECMA1
SCHEMBL8674112 0.90 ELANE (0.63) ELANECMA1
SCHEMBL8145232 0.90 ELANE (0.63) ELANECMA1
SCHEMBL5801511 0.90 ELANE (0.63) ELANECMA1
SCHEMBL7552455 0.90 ELANE (0.63) ELANECMA1
SCHEMBL7373453 0.90 ELANE (0.63) ELANECMA1
SCHEMBL8672185 0.90 ELANE (0.63) ELANECMA1
SCHEMBL7379996 0.90 ELANE (0.63) ELANECMA1

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
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-0762887-A1 ACYLATED ENOL DERIVATIVES AS PRODRUGS OF ELASTASE INHIBITORS MERRELL PHARMACEUTICALS INC. (US) 1997-03-19 EP disclosed
WO-1995033478-A1 ACYLATED ENOL DERIVATIVES AS PRODRUGS OF ELASTASE INHIBITORS MERRELL PHARMACEUTICALS INC. (US) 1995-12-14 WO disclosed