SCHEMBL10383406

SCHEMBL10383406

CCCCCCCC(S)(S)[C@H](NC(C)C(=O)N1CCC[C@H]1C(=O)O)C(=O)OCC

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 10/20 0.53
▸ LMNA P02545 2/20 0.53
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ 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

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
SCHEMBL10385067 0.90 ACE (0.44) ACELMNASMN1; SMN2RENKDM4E
SCHEMBL10383381 0.89 ACE (0.42) ACELMNASMN1; SMN2RENKDM4E
Maleic Acid SCHEMBL10383733 0.86 SMN1; SMN2 (0.47) ACELMNASMN1; SMN2RENKDM4E
SCHEMBL7271796 0.80 ACE (0.66) ACELMNASMN1; SMN2RENKDM4E
SCHEMBL683465 0.79 ACE (0.73) ACELMNASMN1; SMN2RENKDM4E
SCHEMBL10385069 0.78 MEN1 (0.40) ACEMAPTHSD17B10ACE2
SCHEMBL10796062 0.78 ACE (0.59) ACELMNASMN1; SMN2RENKDM4E
SCHEMBL10796436 0.78 ACE (0.59) ACELMNASMN1; SMN2RENKDM4E
SCHEMBL10796078 0.78 ACE (0.59) ACELMNASMN1; SMN2RENKDM4E
SCHEMBL10796279 0.78 ACE (0.59) 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-4977179-A Inhibiting angiotensin converting enzyme OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 1990-12-11 — — US disclosed
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