SCHEMBL10799388

SCHEMBL10799388

CCOC(=O)CSC[C@H](NC(C)C(=O)N1CCC[C@H]1C(=O)O)C(=O)OCC

nearest known ligand 0.62

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 13/20 0.62
▸ LMNA P02545 2/20 0.62
▸ SMN1; SMN2 Q16637 1/20 0.58
▸ REN P00797 4/20 0.46
▸ KDM4E B2RXH2 1/20 0.46
▸ F2 P00734 1/20 0.46
▸ LTA4H P09960 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ PEPD P12955 1/20 0.46
▸ ALOX15 P16050 1/20 0.46
▸ PTGS1 P23219 1/20 0.46
▸ HTR2A P28223 1/20 0.46
▸ PTGS2 P35354 1/20 0.46
▸ HRH1 P35367 1/20 0.46
▸ THPO P40225 1/20 0.46
▸ PMP22 Q01453 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ ACE2 Q9BYF1 1/20 0.46
▸ ABCB11 O95342 1/20 0.42

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
SCHEMBL10799424 1.00 ACE (0.62) ACELMNASMN1; SMN2RENKDM4E
SCHEMBL10935346 0.88 CYP1A2 (0.50) ACELMNASMN1; SMN2MAPTPEPD
SCHEMBL10935341 0.88 CYP1A2 (0.50) ACELMNASMN1; SMN2MAPTPEPD
SCHEMBL10521885 0.88 ACE (0.58) ACELMNASMN1; SMN2RENKDM4E
SCHEMBL10521862 0.88 ACE (0.58) ACELMNASMN1; SMN2RENKDM4E
SCHEMBL10522076 0.86 ACE (0.60) ACELMNASMN1; SMN2RENKDM4E
SCHEMBL10385092 0.86 ACE (0.60) ACELMNASMN1; SMN2RENKDM4E
SCHEMBL10385094 0.86 ACE (0.60) ACELMNASMN1; SMN2RENKDM4E
SCHEMBL10796212 0.86 ACE (0.60) ACELMNASMN1; SMN2RENKDM4E
SCHEMBL10522090 0.86 ACE (0.60) ACELMNASMN1; SMN2RENKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4642355-A ANGIOTENSIN CONVERTING ENZYME INHIBITORS OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 1987-02-10 — — US disclosed
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