SCHEMBL7302883

SCHEMBL7302883

NCCCC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NC[C@H](CC1(C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)O)CCCC1)C(=O)O

nearest known ligand 0.82

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MME P08473 4/20 0.82
ACE P12821 3/20 0.82
ECE1 P42892 3/20 0.82
NPPA P01160 1/20 0.82
MMP2 P08253 1/20 0.45
MMP9 P14780 1/20 0.45
ITGB1 P05556 1/20 0.43
ITGA4 P13612 1/20 0.43
ITGB3 P05106 3/20 0.42
ITGA2B P08514 3/20 0.42
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
CPB2 Q96IY4 1/20 0.41
CHRNA1 P02708 1/20 0.41
CHRNG P07510 1/20 0.41
CHRNB1 P11230 1/20 0.41
CHRND Q07001 1/20 0.41
MMP1 P03956 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
SCHEMBL7302871 1.00 MME (0.82) MMEACEECE1NPPAMMP2
Sampatrilat SCHEMBL4567110 0.90 ECE1 (1.00) MMEACEECE1NPPAITGB1
Sampatrilat SCHEMBL49066 0.90 ECE1 (1.00) MMEACEECE1NPPAITGB1
Sampatrilat SCHEMBL7301333 0.90 ECE1 (1.00) MMEACEECE1NPPAITGB1
SCHEMBL6441043 0.86 ACE (0.81) MMEACEECE1NPPAITGB3
SCHEMBL7294367 0.85 ACE (0.91) MMEACEECE1NPPAITGB3
SCHEMBL7293863 0.85 MME (0.77) MMEACEECE1NPPAMMP2
SCHEMBL7293852 0.85 MME (0.77) MMEACEECE1NPPAMMP2
SCHEMBL7293844 0.85 MME (0.77) MMEACEECE1NPPAMMP2
SCHEMBL7300825 0.83 MME (0.71) MMEACEECE1NPPAITGB1

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-0358398-B1 CYCLOALKYL-SUBSTITUTED GLUTARAMIDE ANTIHYPERTENSIVE AGENTS Pfizer Limited (GB) 1993-03-10 EP claimed
EP-0358398-A1 Cycloalkyl-substituted glutaramide antihypertensive agents Pfizer Limited (GB) 1990-03-14 EP claimed
EP-0358398-A1 Cycloalkyl-substituted glutaramide antihypertensive agents Pfizer Limited (GB) 1990-03-14 EP disclosed