SCHEMBL7305436

SCHEMBL7305436

CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H]1C(=O)OCc1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CMA1 P23946 15/20 0.65
ELANE P08246 1/20 0.56
CTSL P07711 1/20 0.55
FKBP1A P62942 1/20 0.55
KLK5 Q9Y337 1/20 0.54
CTRC Q99895 2/20 0.54

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
SCHEMBL8366717 1.00 CMA1 (0.65) CMA1ELANECTSLFKBP1AKLK5
SCHEMBL7285235 0.93 CMA1 (0.60) CMA1ELANECTSL
SCHEMBL8365035 0.92 CMA1 (0.56) CMA1CTSLFKBP1AKLK5
SCHEMBL7336587 0.92 CMA1 (0.56) CMA1CTSLFKBP1AKLK5
SCHEMBL7336591 0.92 CMA1 (0.56) CMA1CTSLFKBP1AKLK5
SCHEMBL7265704 0.91 PREP (0.61) CMA1CTSLFKBP1AKLK5
SCHEMBL9699149 0.91 PREP (0.61) CMA1CTSLFKBP1AKLK5
SCHEMBL10882017 0.91 PREP (0.61) CMA1CTSLFKBP1AKLK5
SCHEMBL28545846 0.91 PREP (0.61) CMA1CTSLFKBP1AKLK5
SCHEMBL1992452 0.90 FKBP1A (0.60) CMA1ELANECTSLFKBP1A

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 9 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
EP-0494071-A2 Trifluoromethylketone tripeptide derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-07-08 EP disclosed
US-4971993-A HYPOTENSIVE DIPEPTIDES DERIVATIVES AJINOMOTO CO., INC. (JP) 1990-11-20 US disclosed
US-4691007-A HUMAN LEUKOCYTE ELASTASE INHIBITORS ICI AMERICAS INC. (US) 1987-09-01 US disclosed
EP-0190852-A2 Dipeptide derivatives and antihypertensive drugs containing them AJINOMOTO CO., INC. (JP) 1986-08-13 EP disclosed
US-4596789-A Pharmaceuticals ICI AMERICAS INC. (US) 1986-06-24 US disclosed
EP-0124317-A2 Proline derivatives ICI AMERICAS INC. (US) 1984-11-07 EP disclosed