SCHEMBL7263639

SCHEMBL7263639

C[C@H](NP(=O)(Cc1ccccc1)Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)OCc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 1/20 0.48
▸ ACE P12821 7/20 0.47
▸ CMA1 P23946 2/20 0.47
▸ LMNA P02545 1/20 0.47
▸ PREP P48147 2/20 0.46
▸ CTRB1 P17538 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ STAT3 P40763 3/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ FAP Q12884 1/20 0.43
▸ ACE2 Q9BYF1 4/20 0.42

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
SCHEMBL7273272 0.90 PREP (0.50) RENACELMNAPREPCTRB1
SCHEMBL7265589 0.90 PREP (0.50) RENACELMNAPREPCTRB1
SCHEMBL7272969 0.86 CMA1 (0.49) RENACECMA1LMNAPREP
SCHEMBL7271793 0.85 ACE (0.56) RENACECMA1LMNASMN1; SMN2
SCHEMBL7273277 0.84 ACE (0.47) RENACECMA1LMNAPREP
SCHEMBL7273065 0.84 ACE (0.52) ACECMA1LMNAACE2
SCHEMBL10932183 0.84 FKBP1A (0.56) ACELMNAPREPACE2
SCHEMBL7264182 0.83 ACE (0.56) ACECMA1ACE2
SCHEMBL7263810 0.83 ACE (0.52) ACECMA1LMNAACE2
SCHEMBL7265461 0.83 LMNA (0.53) ACECMA1LMNASMN1; SMN2

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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