SCHEMBL7272969

SCHEMBL7272969

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

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CMA1 P23946 1/20 0.49
▸ KMT2A Q03164 1/20 0.47
▸ PREP P48147 2/20 0.47
▸ ACE P12821 2/20 0.45
▸ LMNA P02545 2/20 0.45
▸ ACE2 Q9BYF1 2/20 0.45
▸ PRCP P42785 1/20 0.45
▸ CTRB1 P17538 1/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ REN P00797 1/20 0.44
▸ FKBP1A P62942 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ HTT P42858 1/20 0.43
▸ TSHR P16473 2/20 0.43
▸ CYP3A4 P08684 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ CYP2C9 P11712 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ KDM4E B2RXH2 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
SCHEMBL7263961 0.89 ACE (0.48) CMA1KMT2AACELMNAACE2
SCHEMBL7273272 0.87 PREP (0.50) KMT2APREPACELMNAACE2
SCHEMBL7265589 0.87 PREP (0.50) KMT2APREPACELMNAACE2
SCHEMBL10932183 0.87 FKBP1A (0.56) PREPACELMNAACE2FKBP1A
SCHEMBL7263639 0.86 REN (0.48) CMA1KMT2APREPACELMNA
SCHEMBL7273048 0.84 FKBP1A (0.52) PREPACELMNAFKBP1ATSHR
SCHEMBL7264235 0.84 FKBP1A (0.52) PREPACELMNAFKBP1ATSHR
SCHEMBL7264225 0.83 ACE (0.61) ACELMNAACE2SMN1; SMN2
SCHEMBL7264237 0.83 ACE (0.61) ACELMNAACE2SMN1; SMN2
SCHEMBL7273277 0.80 ACE (0.47) CMA1PREPACELMNAACE2

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 3 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-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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