SCHEMBL8303703

SCHEMBL8303703

C[C@H](CSC(=O)CNC(=O)Oc1cccc(CON(O)O)c1)C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ACE P12821 13/20 0.43
ACE2 Q9BYF1 5/20 0.42
LMNA P02545 1/20 0.41
PRSS1 P07477 1/20 0.40
TMPRSS15 P98073 1/20 0.40
FKBP1A P62942 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
SCHEMBL14600119 0.89 ACE (0.40) ACEACE2LMNAPRSS1TMPRSS15
SCHEMBL8301478 0.86 FKBP1A (0.37) ACEACE2LMNAPRSS1TMPRSS15
SCHEMBL8300095 0.85 FKBP1A (0.37) ACEACE2LMNAPRSS1TMPRSS15
SCHEMBL8303941 0.85 FKBP1A (0.39) ACEACE2LMNAPRSS1TMPRSS15
SCHEMBL8300106 0.83 FKBP1A (0.38) ACEACE2LMNAPRSS1TMPRSS15
SCHEMBL8299265 0.82 ACE (0.48) ACEACE2LMNAPRSS1TMPRSS15
SCHEMBL8299271 0.81 FKBP1A (0.38) ACEACE2LMNAFKBP1A
SCHEMBL8301496 0.81 FKBP1A (0.38) ACEACE2LMNAFKBP1A
SCHEMBL8299270 0.79 ACE (0.36) ACEACE2LMNAFKBP1A
SCHEMBL8303009 0.78 ACE (0.44) ACEACE2LMNA

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004106300-A1 CAPTOPRIL DERIVATIVES NICOX S.A. (FR) 2004-12-09 WO disclosed