SCHEMBL9697243

SCHEMBL9697243

CC(C)CC(CP(=O)(O)C(C)N)C(=O)O

nearest known ligand 0.77

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LAP3 P28838 4/20 0.77
ANPEP P15144 4/20 0.77
SLC1A3 P43003 1/20 0.53
SLC1A2 P43004 1/20 0.53
ERAP1 Q9NZ08 3/20 0.46
IL1RN P18510 2/20 0.46
ERAP2 Q6P179 2/20 0.46
SLC7A5 Q01650 1/20 0.45

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
SCHEMBL9697359 0.85 ANPEP (0.56) LAP3ANPEPSLC1A3SLC1A2ERAP2
SCHEMBL9696270 0.81 ANPEP (0.53) LAP3ANPEPERAP2
SCHEMBL9696208 0.81 FOLH1 (0.60) LAP3ANPEP
SCHEMBL9696300 0.81 ANPEP (0.53) LAP3ANPEPERAP2
SCHEMBL27431060 0.80 LAP3 (0.65) LAP3ANPEPSLC1A3SLC1A2ERAP1
SCHEMBL9715079 0.80 CHRM1 (0.52) LAP3ANPEPSLC1A3SLC1A2
SCHEMBL7605053 0.79 FOLH1 (0.62) LAP3ANPEP
SCHEMBL9697381 0.77 SLC1A2 (0.53) LAP3ANPEPSLC1A3SLC1A2
SCHEMBL9696243 0.76 ANPEP (0.46) LAP3ANPEP
SCHEMBL9797611 0.76 SLC7A5 (0.46) LAP3ANPEPSLC1A3SLC1A2SLC7A5

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
US-5143908-A Carboxylic acids containing amino and phosphinyl groups MERCK & CO., INC. (US) 1992-09-01 US disclosed
US-5099063-A 3-(1-aminoalkylphosphinyl)-(2-substituted)propionic acids MERCK & CO., INC. (US) 1992-03-24 US disclosed
EP-0266978-A2 Novel antibacterial agents and potentiators of carbapenem antibiotics MERCK & CO. INC. (US) 1988-05-11 EP disclosed
US-4715994-A PHOSPHINIC ACID DERIVATIVES MERCK & CO., INC. (US) 1987-12-29 US disclosed