SCHEMBL9359129

SCHEMBL9359129

O=C(O)C(Cc1ccccc1)OC(=O)N1CCSCC1

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.49
ACE P12821 1/20 0.49
SRR Q9GZT4 2/20 0.49
PPARG P37231 14/20 0.45
PPARA Q07869 12/20 0.45

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
SCHEMBL9359132 1.00 DPP4 (0.49) DPP4ACESRRPPARGPPARA
SCHEMBL9354866 0.93 DPP4 (0.57) DPP4ACESRRPPARGPPARA
SCHEMBL9354873 0.93 DPP4 (0.57) DPP4ACESRRPPARGPPARA
SCHEMBL9740018 0.87 DPP4 (0.45) DPP4PPARGPPARA
SCHEMBL9354547 0.87 MEN1 (0.47) DPP4PPARGPPARA
SCHEMBL9354537 0.87 MEN1 (0.47) DPP4PPARGPPARA
SCHEMBL9359097 0.86 SRR (0.51) ACESRRPPARGPPARA
SCHEMBL8909660 0.86 SRR (0.51) ACESRRPPARGPPARA
SCHEMBL8682156 0.86 SRR (0.51) ACESRRPPARGPPARA
SCHEMBL9740620 0.83 ACE (0.49) ACESRRPPARGPPARA

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0300189-B1 New amino acid derivatives, processes for the preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO (JP) 1994-11-02 EP disclosed
US-5223489-A Treatment of ypertension and heart failure UJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-06-29 US disclosed
US-5142048-A Enzyme inhibitor; carbamoyl group-containing acids FUJISAWA PHARMACEUTICAL COMPANY, LTD. (JP) 1992-08-25 US disclosed
US-4921855-A New Histidyl amino acid derivatives, and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1990-05-01 US disclosed
EP-0300189-A2 New amino acid derivatives, processes for the preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1989-01-25 EP disclosed