SCHEMBL11563200

SCHEMBL11563200

CC(C(=O)O)C(=O)N1C[C@H](O)C[C@H]1C(=O)O

nearest known ligand 0.65

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.61
PIK3CD O00329 2/20 0.45
DPP4 P27487 4/20 0.41
DPP8 Q6V1X1 4/20 0.41
DPP9 Q86TI2 4/20 0.41
PRSS1 P07477 2/20 0.40
TMPRSS15 P98073 2/20 0.40
DPP7 Q9UHL4 1/20 0.39
FAP Q12884 1/20 0.39
ACE P12821 1/20 0.37

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
SCHEMBL4254807 0.86 ATM (0.65) ATMPIK3CDDPP4DPP8DPP9
SCHEMBL4251347 0.86 ATM (0.65) ATMPIK3CDDPP4DPP8DPP9
SCHEMBL4255717 0.86 ATM (0.65) ATMPIK3CDDPP4DPP8DPP9
SCHEMBL12112073 0.86 ATM (0.65) ATMPIK3CDDPP4DPP8DPP9
SCHEMBL4254305 0.86 ATM (0.65) ATMPIK3CDDPP4DPP8DPP9
SCHEMBL4251344 0.86 ATM (0.65) ATMPIK3CDDPP4DPP8DPP9
SCHEMBL4254805 0.86 ATM (0.65) ATMPIK3CDDPP4DPP8DPP9
SCHEMBL4441243 0.83 ATM (0.61) ATMPIK3CDDPP4DPP8DPP9
SCHEMBL4441246 0.83 ATM (0.61) ATMPIK3CDDPP4DPP8DPP9
SCHEMBL15756825 0.83 ATM (0.61) ATMPIK3CDDPP4DPP8DPP9

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-4154937-A ANGIOTENSIN CONVERTING ENZYME INHIBITORS E. R. SQUIBB & SONS, INC. (US) 1979-05-15 US disclosed
US-4128653-A Reduction of blood pressure with carboxyalkylacyl-pipecolic acid derivatives E. R. SQUIBB & SONS, INC. (US) 1978-12-05 US disclosed
US-4086338-A HYPOTENSIVE AGENTS, ANGIOTENSIN CONVERTING ENZYME INHIBITORS E. R. SQUIBB & SONS, INC. (US) 1978-04-25 US disclosed
US-4052511-A ANGIOTENSIN CONVERTING ENZYME INHIBITORS E. R. SQUIBB & SONS, INC. (US) 1977-10-04 US disclosed