SCHEMBL10521862

SCHEMBL10521862

CCOC(=O)[C@H](CSCC(=O)NC1CCCC1)NC(C)C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 11/20 0.58
▸ LMNA P02545 2/20 0.58
▸ SMN1; SMN2 Q16637 1/20 0.54
▸ REN P00797 4/20 0.43
▸ KDM4E B2RXH2 1/20 0.42
▸ F2 P00734 1/20 0.42
▸ LTA4H P09960 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ PEPD P12955 1/20 0.42
▸ ALOX15 P16050 1/20 0.42
▸ PTGS1 P23219 1/20 0.42
▸ HTR2A P28223 1/20 0.42
▸ PTGS2 P35354 1/20 0.42
▸ HRH1 P35367 1/20 0.42
▸ THPO P40225 1/20 0.42
▸ PMP22 Q01453 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ ACE2 Q9BYF1 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
SCHEMBL10521885 1.00 ACE (0.58) ACELMNASMN1; SMN2RENKDM4E
SCHEMBL10520350 0.89 ACE (0.45) ACELMNASMN1; SMN2KDM4EMAPT
SCHEMBL10520357 0.89 ACE (0.45) ACELMNASMN1; SMN2KDM4EMAPT
SCHEMBL10799424 0.88 ACE (0.62) ACELMNASMN1; SMN2RENKDM4E
SCHEMBL10799388 0.88 ACE (0.62) ACELMNASMN1; SMN2RENKDM4E
SCHEMBL10522919 0.83 HPGD (0.40) ACELMNASMN1; SMN2KDM4E
SCHEMBL10522924 0.83 HPGD (0.40) ACELMNASMN1; SMN2KDM4E
SCHEMBL10384301 0.82 ACE (0.58) ACELMNASMN1; SMN2RENKDM4E
SCHEMBL10383741 0.82 ACE (0.58) ACELMNASMN1; SMN2RENKDM4E
SCHEMBL10385094 0.82 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-4886813-A INHIBITORS OF ANGIOTENSIN CONVERTING ENZYME OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 1989-12-12 — — US disclosed
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