SCHEMBL6996700

SCHEMBL6996700

O=C(O)[C@@H]1CCc2c(Cl)nc(Cl)c(=O)n21

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ACE P12821 4/20 0.44
PREP P48147 8/20 0.40
F2 P00734 1/20 0.37
F7 P08709 1/20 0.37
F3 P13726 1/20 0.37

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
SCHEMBL5801831 0.83 ACE (0.39) ACEPREPF2F7F3
SCHEMBL5748164 0.83 ACE (0.39) ACEPREPF2F7F3
SCHEMBL5748168 0.80 ACE (0.39) ACEPREPF2F7F3
SCHEMBL5801832 0.80 ACE (0.39) ACEPREPF2F7F3
SCHEMBL5729773 0.80 F7 (0.58) ACEF2F7F3
SCHEMBL31486289 0.80 F7 (0.58) ACEF2F7F3
SCHEMBL31565049 0.77 FKBP1A (0.47) PREPF2F7F3
SCHEMBL31486297 0.77 FKBP1A (0.47) PREPF2F7F3
SCHEMBL31486250 0.75 ACE (0.39) ACEPREPF2F7F3
SCHEMBL31486229 0.75 PREP (0.51) ACEPREPF2F7F3

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-1069132-B1 Bicyclic derivatives of amino-pyrazinones, process of preparation and pharmaceutical compositions comprising them SERVIER LAB (FR) 2003-10-01 EP disclosed
US-6277851-B1 ORALLY ADMINISTERED TRYPSIN-RELATED SERINE PROTEASE INHIBITORS; ANTICOAGULANTS ADIR ET COMPAGNIE (FR) 2001-08-21 US disclosed
EP-1069132-A1 Bicyclic derivatives of amino-pyrazinones, process of preparation and pharmaceutical compositions comprising them ADIR ET COMPAGNIE (FR) 2001-01-17 EP disclosed