SCHEMBL7312264

SCHEMBL7312264

CC(C)C[C@H](NC(CCc1ccccc1)P(=O)(O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ACE P12821 7/20 0.58
ERAP2 Q6P179 1/20 0.56
ERAP1 Q9NZ08 1/20 0.56
LNPEP Q9UIQ6 1/20 0.56
FOLH1 Q04609 1/20 0.55
CPA1 P15085 2/20 0.54
CPA2 P48052 2/20 0.54
CPA4 Q9UI42 2/20 0.54
MMP1 P03956 1/20 0.51

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
SCHEMBL7312238 1.00 ACE (0.58) ACEERAP2ERAP1LNPEPFOLH1
SCHEMBL6412335 0.87 MMP1 (0.56) ERAP2ERAP1LNPEPCPA1CPA2
SCHEMBL6412324 0.87 MMP1 (0.56) ERAP2ERAP1LNPEPCPA1CPA2
SCHEMBL7307608 0.85 ERAP2 (0.62) ACEERAP2ERAP1LNPEP
SCHEMBL7342912 0.85 ECE1 (0.54) ACEERAP2ERAP1CPA1CPA2
SCHEMBL7305651 0.82 MMP3 (0.52) ACEERAP2ERAP1LNPEPCPA1
SCHEMBL6418666 0.82 MMP1 (0.52) CPA1CPA2CPA4MMP1
SCHEMBL6418679 0.82 MMP1 (0.52) CPA1CPA2CPA4MMP1
SCHEMBL7306489 0.81 ERAP2 (0.68) ACEERAP2ERAP1LNPEP
SCHEMBL7312249 0.79 ERAP2 (0.47) ERAP2ERAP1LNPEPCPA1CPA2

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
US-5380921-A Enzyme inhibitors for endothelin converting enzyme for cardiovascular disorders and atherosclerosis BANYU PHARMACEUTICAL CO., LTD. (JP) 1995-01-10 US disclosed
EP-0623625-A1 Aminophosphonic acid derivative BANYU PHARMACEUTICAL CO., LTD. (JP) 1994-11-09 EP disclosed