SCHEMBL7307608

SCHEMBL7307608

CC(C)C[C@H](NC(CCc1ccc(O)cc1)P(=O)(O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ERAP2 Q6P179 9/20 0.62
ERAP1 Q9NZ08 9/20 0.62
ANPEP P15144 5/20 0.62
IL1RN P18510 5/20 0.61
ECE1 P42892 5/20 0.57
PYGB P11216 1/20 0.57
LNPEP Q9UIQ6 3/20 0.55
MMP2 P08253 1/20 0.54
MMP9 P14780 1/20 0.54
MMP8 P22894 1/20 0.54
ACE P12821 1/20 0.54

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
SCHEMBL7306489 0.95 ERAP2 (0.68) ERAP2ERAP1ANPEPIL1RNECE1
SCHEMBL7304171 0.92 ECE1 (0.63) ERAP2ERAP1ANPEPIL1RNECE1
SCHEMBL7306818 0.91 ERAP1 (0.59) ERAP2ERAP1ANPEPIL1RNECE1
SCHEMBL7315009 0.91 ERAP2 (0.64) ERAP2ERAP1ANPEPIL1RNECE1
SCHEMBL7307671 0.89 ERAP2 (0.58) ERAP2ERAP1ANPEPIL1RNECE1
SCHEMBL7315378 0.88 ECE1 (0.63) ERAP2ERAP1ANPEPIL1RNECE1
SCHEMBL7312238 0.85 ACE (0.58) ERAP2ERAP1LNPEPACE
SCHEMBL7312264 0.85 ACE (0.58) ERAP2ERAP1LNPEPACE
SCHEMBL14223176 0.85 ANPEP (0.58) ERAP2ERAP1ANPEPIL1RNECE1
SCHEMBL14193654 0.85 ANPEP (0.58) ERAP2ERAP1ANPEPIL1RNECE1

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