SCHEMBL3360876

SCHEMBL3360876

O=C(O)C1CCCN1N1CCC[C@H]1C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ACE P12821 8/20 0.46
REN P00797 1/20 0.43
LMNA P02545 1/20 0.43
CYP2C19 P33261 1/20 0.43
HSD17B10 Q99714 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
SCHEMBL7113056 1.00 ACE (0.46) ACERENLMNACYP2C19HSD17B10
SCHEMBL10905425 0.86 ACE (0.41) ACERENLMNACYP2C19HSD17B10
SCHEMBL28439470 0.86 ACE (0.41) ACERENLMNACYP2C19HSD17B10
SCHEMBL27718628 0.84 ACE (0.40) ACERENLMNACYP2C19HSD17B10
SCHEMBL4963186 0.84 ACE (0.40) ACERENLMNACYP2C19HSD17B10
SCHEMBL28064542 0.84 ACE (0.37) ACERENLMNACYP2C19HSD17B10
SCHEMBL1356515 0.84 ACE (0.40) ACERENLMNACYP2C19HSD17B10
SCHEMBL22418322 0.83 ACE (0.35) ACE
SCHEMBL27988623 0.82 ATM (0.44) ACEREN
SCHEMBL2709523 0.82 DPP4 (0.41)

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-8269037-B2 Absorption medium for removing acid gases which comprises amino acid and acid promoter BASF SE (DE) 2012-09-18 US disclosed
US-20100186590-A1 ABSORPTION MEDIUM FOR REMOVING ACID GASES WHICH COMPRISES AMINO ACID AND ACID PROMOTER BASF SE (DE) 2010-07-29 US disclosed
EP-0731788-A1 PROLYL ENDOPEPTIDASE INHIBITORS MERRELL PHARMACEUTICALS INC. (US) 1996-09-18 EP disclosed
WO-1995015310-A1 PROLYL ENDOPEPTIDASE INHIBITORS MERRELL PHARMACEUTICALS INC. (US) 1995-06-08 WO disclosed