SCHEMBL7160195

SCHEMBL7160195

CCCCCSCC(C)C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 6/20 0.58
▸ REN P00797 4/20 0.58
▸ KDM4E B2RXH2 1/20 0.58
▸ F2 P00734 1/20 0.58
▸ LMNA P02545 1/20 0.58
▸ LTA4H P09960 1/20 0.58
▸ MAPT P10636 1/20 0.58
▸ PEPD P12955 1/20 0.58
▸ ALOX15 P16050 1/20 0.58
▸ PTGS1 P23219 1/20 0.58
▸ HTR2A P28223 1/20 0.58
▸ PTGS2 P35354 1/20 0.58
▸ HRH1 P35367 1/20 0.58
▸ THPO P40225 1/20 0.58
▸ PMP22 Q01453 1/20 0.58
▸ HSD17B10 Q99714 1/20 0.58
▸ ACE2 Q9BYF1 1/20 0.58

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
SCHEMBL6016754 0.99 ACE (0.56) ACERENKDM4EF2LMNA
SCHEMBL6016753 0.99 ACE (0.56) ACERENKDM4EF2LMNA
SCHEMBL6016755 0.99 ACE (0.56) ACERENKDM4EF2LMNA
SCHEMBL10801296 0.85 ACE (0.55) ACERENKDM4EF2LMNA
SCHEMBL10796478 0.84 ACE (0.54) ACERENKDM4EF2LMNA
SCHEMBL10796676 0.84 ACE (0.54) ACERENKDM4EF2LMNA
SCHEMBL10796081 0.84 ACE (0.54) ACERENKDM4EF2LMNA
SCHEMBL10800239 0.84 ACE (0.54) ACERENKDM4EF2LMNA
SCHEMBL10935359 0.82 ACE (0.60) ACERENKDM4EF2LMNA
SCHEMBL10796212 0.82 ACE (0.60) ACERENKDM4EF2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0802182-B1 PROCESS FOR PRODUCING N-(D-alpha-METHYL-beta-MERCAPTOPROPIONYL)-L-PROLINE AND INTERMEDIATES THEREOF KANEKA CORP (JP) 2003-08-27 — — EP claimed
US-5917055-A CAPTOPRIL KANEKA CORPORATION (JP) 1999-06-29 — — US claimed
EP-0802182-A1 PROCESS FOR PRODUCING N-(D-$g(a)-METHYL-$g(b)-MERCAPTOPROPIONYL)-L-PROLINE AND INTERMEDIATES THEREOF KANEKA CORPORATION (JP) 1997-10-22 — — EP claimed
EP-0802182-B1 PROCESS FOR PRODUCING N-(D-alpha-METHYL-beta-MERCAPTOPROPIONYL)-L-PROLINE AND INTERMEDIATES THEREOF KANEKA CORP (JP) 2003-08-27 — — EP disclosed
US-5917055-A CAPTOPRIL KANEKA CORPORATION (JP) 1999-06-29 — — US disclosed
EP-0802182-A1 PROCESS FOR PRODUCING N-(D-$g(a)-METHYL-$g(b)-MERCAPTOPROPIONYL)-L-PROLINE AND INTERMEDIATES THEREOF KANEKA CORPORATION (JP) 1997-10-22 — — EP disclosed
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