SCHEMBL7273065

SCHEMBL7273065

C[C@H](NP(=O)(Cc1ccccc1)Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 8/20 0.52
▸ CMA1 P23946 5/20 0.51
▸ CPA1 P15085 1/20 0.47
▸ CPA2 P48052 1/20 0.47
▸ CPA4 Q9UI42 1/20 0.47
▸ ACE2 Q9BYF1 5/20 0.46
▸ LMNA P02545 1/20 0.44
▸ OPRM1 P35372 2/20 0.44
▸ ELANE P08246 1/20 0.44
▸ CTSG P08311 1/20 0.44
▸ SLC6A2 P23975 1/20 0.43

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
SCHEMBL7264182 0.92 ACE (0.56) ACECMA1ACE2OPRM1ELANE
SCHEMBL7263810 0.92 ACE (0.52) ACECMA1CPA1CPA2CPA4
SCHEMBL7263953 0.88 SLC6A2 (0.57) ACECMA1ACE2OPRM1SLC6A2
Arginine SCHEMBL7270315 0.87 EPHA2 (0.47) ACECMA1OPRM1SLC6A2
SCHEMBL7273277 0.85 ACE (0.47) ACECMA1CPA1CPA2CPA4
SCHEMBL7263961 0.85 ACE (0.48) ACECMA1CPA1CPA2CPA4
SCHEMBL7263639 0.84 REN (0.48) ACECMA1ACE2LMNA
SCHEMBL7264237 0.84 ACE (0.61) ACEACE2LMNA
SCHEMBL7264225 0.84 ACE (0.61) ACEACE2LMNA
SCHEMBL7271793 0.84 ACE (0.56) ACECMA1ACE2LMNAELANE

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-4590178-A DIURETICS AJINOMOTO COMPANY, INCORPORATED (JP) 1986-05-20 — — US disclosed
US-4536395-A DIPEPTIDES AJINOMOTO CO., INC. (JP) 1985-08-20 — — US disclosed
US-4472381-A Amino acid derivatives, methods of preparing said derivatives and antihypertensive drugs containing them AJINOMOTO COMPANY INCORPORATED (JP) 1984-09-18 — — US disclosed
EP-0085488-A2 Amino acid derivatives and antihypertensive drugs containing them AJINOMOTO CO., INC. (JP) 1983-08-10 — — EP disclosed
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