SCHEMBL7301033

SCHEMBL7301033

CC(C)C(NC(=O)CN(C(=O)[C@@H](NC(=O)c1ccc(C(=O)O)cc1)C(C)C)C1Cc2ccccc2C1)C(=O)C(F)(F)F

nearest known ligand 0.59

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ELANE P08246 17/20 0.59
CTSG P08311 1/20 0.39

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
SCHEMBL7299006 0.91 ELANE (0.56) ELANECTSG
SCHEMBL7300428 0.91 ELANE (0.59) ELANECTSG
SCHEMBL7301626 0.86 ELANE (0.68) ELANE
SCHEMBL6266596 0.81 ELANE (0.49) ELANE
SCHEMBL6266593 0.81 ELANE (0.49) ELANE
SCHEMBL7300078 0.78 ELANE (0.52) ELANE
SCHEMBL6261618 0.78 ELANE (0.49) ELANE
SCHEMBL7301747 0.78 ELANE (0.49) ELANE
SCHEMBL6261622 0.78 ELANE (0.49) ELANE
SCHEMBL7442937 0.76 ELANE (0.47) ELANE

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
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