SCHEMBL7270446

SCHEMBL7270446

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

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ DPP8 Q6V1X1 6/20 0.46
▸ DPP4 P27487 6/20 0.46
▸ DPP7 Q9UHL4 6/20 0.46
▸ DPP9 Q86TI2 3/20 0.46
▸ FAP Q12884 2/20 0.46

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
SCHEMBL10829111 0.91 DPP7 (0.44) DPP8DPP4DPP7DPP9FAP
Arginine SCHEMBL7264280 0.89 DPP8 (0.37) DPP8DPP4DPP7DPP9FAP
SCHEMBL7271634 0.85 ACE (0.40) DPP8DPP4DPP7DPP9FAP
Lysine SCHEMBL7265717 0.80 ACE (0.43) DPP8
Arginine SCHEMBL7265631 0.79 PLK1 (0.34) —
SCHEMBL11017609 0.75 DPP7 (0.60) DPP8DPP4DPP7DPP9FAP
SCHEMBL10829152 0.75 DPP7 (0.60) DPP8DPP4DPP7DPP9FAP
SCHEMBL7264201 0.75 DPP8 (0.41) DPP8DPP4DPP7DPP9FAP
SCHEMBL7265473 0.74 ACE (0.40) DPP8DPP4DPP7DPP9FAP
SCHEMBL2123080 0.74 DPP7 (0.65) DPP8DPP4DPP7DPP9FAP

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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