SCHEMBL7271634

SCHEMBL7271634

CCP(=O)(CC)[C@@]1(C(=O)O)CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](C)N

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 7/20 0.40
▸ REN P00797 3/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ F2 P00734 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ LTA4H P09960 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ PEPD P12955 1/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ PTGS1 P23219 1/20 0.40
▸ HTR2A P28223 1/20 0.40
▸ PTGS2 P35354 1/20 0.40
▸ HRH1 P35367 1/20 0.40
▸ THPO P40225 1/20 0.40
▸ PMP22 Q01453 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ ACE2 Q9BYF1 1/20 0.40
▸ DPP4 P27487 3/20 0.39
▸ FAP Q12884 2/20 0.39
▸ DPP7 Q9UHL4 2/20 0.39

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
SCHEMBL7265481 0.85 ERAP2 (0.42) ACEACE2
SCHEMBL7270446 0.85 DPP8 (0.46) DPP4FAPDPP7DPP8DPP9
Arginine SCHEMBL7265631 0.85 PLK1 (0.34) XIAP
Ammonia Solution, Strong SCHEMBL10829251 0.84 ERAP2 (0.42) ACEACE2
SCHEMBL7263793 0.82 PREP (0.44) ACEACE2PREP
SCHEMBL7272884 0.82 DPP4 (0.39) DPP4FAPDPP7PREPDPP8
SCHEMBL7272811 0.78 ERAP2 (0.43) ACEACE2
Potassium Ion SCHEMBL7265630 0.77 ACE (0.41) ACEACE2
SCHEMBL10829050 0.77 ACE (0.41) ACEACE2
Lysine SCHEMBL7265717 0.77 ACE (0.43) ACEF2ACE2DPP8

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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