SCHEMBL10385067

SCHEMBL10385067

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

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 9/20 0.44
▸ LMNA P02545 2/20 0.44
▸ PEPD P12955 3/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ FKBP1A P62942 3/20 0.38
▸ XPNPEP1 Q9NQW7 1/20 0.37
▸ ACE2 Q9BYF1 2/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ F2 P00734 1/20 0.37
▸ REN P00797 1/20 0.37
▸ LTA4H P09960 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ ALOX15 P16050 1/20 0.37
▸ PTGS1 P23219 1/20 0.37
▸ HTR2A P28223 1/20 0.37
▸ PTGS2 P35354 1/20 0.37
▸ HRH1 P35367 1/20 0.37
▸ THPO P40225 1/20 0.37
▸ PMP22 Q01453 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37

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
SCHEMBL10383381 0.91 ACE (0.42) ACELMNAPEPDSMN1; SMN2FKBP1A
SCHEMBL10383406 0.90 ACE (0.53) ACELMNAPEPDSMN1; SMN2ACE2
Maleic Acid SCHEMBL10383733 0.86 SMN1; SMN2 (0.47) ACELMNAPEPDSMN1; SMN2FKBP1A
SCHEMBL10385066 0.77 ACE (0.49) ACELMNAPEPDSMN1; SMN2FKBP1A
SCHEMBL10385091 0.75 ACE (0.49) ACELMNAPEPDSMN1; SMN2FKBP1A
SCHEMBL10385089 0.75 ACE (0.49) ACELMNAPEPDSMN1; SMN2FKBP1A
SCHEMBL10384321 0.75 MEN1 (0.38) ACESMN1; SMN2MAPTHSD17B10
SCHEMBL18088507 0.74 PEPD (0.47) ACELMNAPEPDSMN1; SMN2FKBP1A
SCHEMBL10385069 0.74 MEN1 (0.40) ACEACE2MAPTHSD17B10
SCHEMBL10383387 0.74 ACE (0.48) ACELMNAPEPDSMN1; SMN2FKBP1A

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 2 patents. 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 claimed
US-4977179-A Inhibiting angiotensin converting enzyme OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 1990-12-11 — — US disclosed
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