SCHEMBL7294361

SCHEMBL7294361

CS(=O)(=O)N[C@@H](CCCCN)C(=O)NCC(CC1(C(=O)NC(=O)[C@@H](N)Cc2ccc(O)cc2)CCCC1)C(=O)O

nearest known ligand 0.80

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MME P08473 5/20 0.80
ACE P12821 3/20 0.80
ECE1 P42892 2/20 0.80
NPPA P01160 1/20 0.80
LNPEP Q9UIQ6 2/20 0.41
ERAP2 Q6P179 1/20 0.40
ITGB3 P05106 1/20 0.39
ITGA2B P08514 1/20 0.39
THRB P10828 1/20 0.38
OPRK1 P41145 1/20 0.37
GRIA1 P42261 1/20 0.37
PSMB1 P20618 1/20 0.36
PSMB8 P28062 1/20 0.36
PSMB9 P28065 1/20 0.36
PSMB5 P28074 1/20 0.36
PSMB10 P40306 1/20 0.36
PSMB2 P49721 1/20 0.36
MMP2 P08253 1/20 0.36

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
Sampatrilat SCHEMBL7301333 0.89 ECE1 (1.00) MMEACEECE1NPPAITGB3
Sampatrilat SCHEMBL4567110 0.89 ECE1 (1.00) MMEACEECE1NPPAITGB3
Sampatrilat SCHEMBL49066 0.89 ECE1 (1.00) MMEACEECE1NPPAITGB3
SCHEMBL7294367 0.88 ACE (0.91) MMEACEECE1NPPAITGB3
SCHEMBL6441043 0.80 ACE (0.81) MMEACEECE1NPPALNPEP
SCHEMBL7302871 0.79 MME (0.82) MMEACEECE1NPPAITGB3
SCHEMBL7302883 0.79 MME (0.82) MMEACEECE1NPPAITGB3
SCHEMBL7293852 0.79 MME (0.77) MMEACEECE1NPPALNPEP
SCHEMBL7293844 0.79 MME (0.77) MMEACEECE1NPPALNPEP
SCHEMBL7293863 0.79 MME (0.77) MMEACEECE1NPPALNPEP

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
EP-0358398-A1 Cycloalkyl-substituted glutaramide antihypertensive agents Pfizer Limited (GB) 1990-03-14 EP disclosed