SCHEMBL7323541

SCHEMBL7323541

COP(=O)(OC)C(CCN)N[C@@H](CC(C)C)C(=O)N(C(N)=O)[C@@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 1/20 0.38
CPA1 P15085 2/20 0.38
CPA2 P48052 2/20 0.38
CPA4 Q9UI42 2/20 0.38
ACE2 Q9BYF1 2/20 0.38
CPB1 P15086 1/20 0.38
LTA4H P09960 1/20 0.37
MME P08473 3/20 0.37
ECE1 P42892 1/20 0.37

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
SCHEMBL7323423 0.90 TACR3 (0.36) ANPEPLTA4H
SCHEMBL7321472 0.90 CA12 (0.37) ANPEPCPA1CPA2CPA4ACE2
SCHEMBL7326674 0.89 MME (0.36) ANPEPCPA1CPA2CPA4ACE2
SCHEMBL7322317 0.87 MMP1 (0.47)
SCHEMBL7328790 0.87 SLC1A3 (0.44) ACE2MMEECE1
SCHEMBL7320171 0.85 CPA1 (0.41) ANPEPCPA1CPA2CPA4ACE2
SCHEMBL6412346 0.82 CPA1 (0.45) CPA1CPA2CPA4ACE2CPB1
SCHEMBL6917414 0.82 MMP1 (0.41) CPA1CPA2CPA4ACE2CPB1
SCHEMBL6417816 0.80 ECE1 (0.40) CPA1CPA2CPA4ACE2CPB1
SCHEMBL6412734 0.79 CPA1 (0.39) CPA1CPA2CPA4ACE2CPB1

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-0612324-A1 PHOSPHONOPEPTIDES WITH COLLAGENASE INHIBITING ACTIVITY SMITHKLINE BEECHAM PLC (GB) 1994-08-31 EP disclosed
WO-1993009136-A1 PHOSPHONOPEPTIDES WITH COLLAGENASE INHIBITING ACTIVITY SMITHKLINE BEECHAM PLC (GB) 1993-05-13 WO disclosed