SCHEMBL7276979

SCHEMBL7276979

NC(=O)C(CCc1ccccc1)N[C@@H](CCCCNC(=O)C(F)(F)F)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MME P08473 1/20 0.47
ACE P12821 3/20 0.44
POLB P06746 2/20 0.42
MLYCD O95822 2/20 0.42
ALDH1A1 P00352 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
TLR2 O60603 1/20 0.40
MMP1 P03956 2/20 0.40
MMP3 P08254 2/20 0.40
MMP2 P08253 1/20 0.39
MMP7 P09237 1/20 0.39
MMP9 P14780 1/20 0.39
MMP13 P45452 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
FOLH1 Q04609 1/20 0.39
MMP8 P22894 1/20 0.39
PTPN2 P17706 1/20 0.39
PTPN1 P18031 1/20 0.39
CHRNB2 P17787 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
SCHEMBL7377576 1.00 MME (0.47) MMEACEPOLBMLYCDALDH1A1
SCHEMBL3373746 0.94 MME (0.52) MMEACEPOLBMLYCDALDH1A1
SCHEMBL14423531 0.94 MME (0.52) MMEACEPOLBMLYCDALDH1A1
SCHEMBL21373191 0.87 MME (0.46) MMEACEPOLBMLYCDMMP2
SCHEMBL30313716 0.87 MME (0.46) MMEACEPOLBMLYCDMMP2
SCHEMBL901541 0.86 MME (0.45) MMEACEPOLBSMN1; SMN2FOLH1
SCHEMBL901542 0.86 MME (0.45) MMEACEPOLBSMN1; SMN2FOLH1
SCHEMBL15101628 0.86 MME (0.45) MMEACEPOLBSMN1; SMN2FOLH1
SCHEMBL21373190 0.84 MME (0.43) MMEACEPOLBMLYCDALDH1A1
SCHEMBL30313811 0.84 MME (0.43) MMEACEPOLBMLYCDALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0336368-B1 N2-(1-carboxy-3-phenylpropyl)-L-lysine derivative and process of producing lysinopril using the compound KANEGAFUCHI CHEMICAL IND (JP) 1995-02-01 EP disclosed
EP-0336368-A2 N2-(1-carboxy-3-phenylpropyl)-L-lysine derivative and process of producing lysinopril using the compound KANEGAFUCHI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1989-10-11 EP disclosed