SCHEMBL7266805

SCHEMBL7266805

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

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSC P53634 2/20 0.44
MLYCD O95822 2/20 0.41
POLB P06746 2/20 0.41
MME P08473 1/20 0.40
CTSS P25774 3/20 0.40
ACE P12821 1/20 0.40
CTSB P07858 2/20 0.40
CTSF Q9UBX1 1/20 0.40
CTSL P07711 1/20 0.39
ALDH1A1 P00352 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MMP1 P03956 1/20 0.38
MMP2 P08253 1/20 0.38
MMP3 P08254 1/20 0.38
MMP7 P09237 1/20 0.38
MMP9 P14780 1/20 0.38
MMP13 P45452 1/20 0.38
FOLH1 Q04609 1/20 0.38
MMP8 P22894 1/20 0.38
MEN1 O00255 1/20 0.38

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
SCHEMBL3373746 0.88 MME (0.52) MLYCDPOLBMMEACEALDH1A1
SCHEMBL14423531 0.88 MME (0.52) MLYCDPOLBMMEACEALDH1A1
SCHEMBL7377576 0.83 MME (0.47) MLYCDPOLBMMEACEALDH1A1
SCHEMBL7276979 0.83 MME (0.47) MLYCDPOLBMMEACEALDH1A1
SCHEMBL30313716 0.81 MME (0.46) MLYCDPOLBMMEACEMMP2
SCHEMBL21373191 0.81 MME (0.46) MLYCDPOLBMMEACEMMP2
SCHEMBL7276530 0.81 CTSC (0.53) CTSCMMEACEMMP2MMP9
SCHEMBL7268746 0.81 CTSC (0.53) CTSCMMEACEMMP2MMP9
SCHEMBL901541 0.80 MME (0.45) POLBMMEACESMN1; SMN2FOLH1
SCHEMBL901542 0.80 MME (0.45) POLBMMEACESMN1; SMN2FOLH1

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