SCHEMBL7303733

SCHEMBL7303733

COC(=O)c1ccc(NC(=O)N[C@H](C(=O)N2CCC[C@H]2C(=O)NC(C(=O)C(F)(F)F)C(C)C)C(C)C)cc1

nearest known ligand 0.84

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ELANE P08246 17/20 0.84
CTSG P08311 1/20 0.53
CMA1 P23946 1/20 0.52

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
SCHEMBL9277429 0.97 ELANE (0.79) ELANECTSGCMA1
SCHEMBL7302317 0.91 ELANE (1.00) ELANECTSGCMA1
SCHEMBL7312617 0.87 ELANE (0.64) ELANECTSGCMA1
SCHEMBL7310232 0.86 ELANE (0.80) ELANECTSGCMA1
SCHEMBL7309861 0.85 ELANE (0.62) ELANECMA1
SCHEMBL7432895 0.84 ELANE (0.74) ELANECTSGCMA1
SCHEMBL7437294 0.82 ELANE (0.71) ELANECTSGCMA1
SCHEMBL7305601 0.82 ELANE (0.70) ELANECTSGCMA1
SCHEMBL7363455 0.81 ELANE (0.65) ELANECTSGCMA1
SCHEMBL4287233 0.81 ELANE (0.65) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0494071-B1 Trifluoromethylketone tripeptide derivatives FUJISAWA PHARMACEUTICAL CO (JP) 1997-04-16 EP disclosed
US-5430025-A Elastase-inhibiting peptides bearing a C-terminal trifluoromethylketone moiety FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1995-07-04 US disclosed
US-5296591-A Enzyme inhibitors FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-03-22 US disclosed