SCHEMBL7306489

SCHEMBL7306489

CC(C)C[C@H](NC(CCc1ccccc1)P(=O)(O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O

nearest known ligand 0.68

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ERAP2 Q6P179 5/20 0.68
ANPEP P15144 5/20 0.68
ERAP1 Q9NZ08 5/20 0.68
PYGB P11216 1/20 0.63
ECE1 P42892 6/20 0.61
IL1RN P18510 2/20 0.60
LNPEP Q9UIQ6 1/20 0.60
ACE P12821 3/20 0.57
MME P08473 1/20 0.55

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
SCHEMBL7315009 0.96 ERAP2 (0.64) ERAP2ANPEPERAP1PYGBECE1
SCHEMBL7307608 0.95 ERAP2 (0.62) ERAP2ANPEPERAP1PYGBECE1
SCHEMBL7304171 0.95 ECE1 (0.63) ERAP2ANPEPERAP1PYGBECE1
SCHEMBL7306818 0.93 ERAP1 (0.59) ERAP2ANPEPERAP1PYGBECE1
SCHEMBL7307671 0.92 ERAP2 (0.58) ERAP2ANPEPERAP1PYGBECE1
SCHEMBL7315378 0.91 ECE1 (0.63) ERAP2ANPEPERAP1PYGBECE1
SCHEMBL14193654 0.90 ANPEP (0.58) ERAP2ANPEPERAP1ECE1IL1RN
SCHEMBL14223176 0.90 ANPEP (0.58) ERAP2ANPEPERAP1ECE1IL1RN
SCHEMBL7327655 0.89 PYGB (0.69) ERAP2ANPEPERAP1PYGBECE1
SCHEMBL17813732 0.89 PYGB (0.69) ERAP2ANPEPERAP1PYGBECE1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-5148277-A None JP disclosed
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
JP-H05148277-A AMINOPHOSPHONIC ACID DERIVATIVE BANYU PHARMACEUT CO LTD 1993-06-15 JP disclosed