SCHEMBL8720595

SCHEMBL8720595

C=CC1CCCN1CC(=O)O

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ACE P12821 3/20 0.36
LTA4H P09960 1/20 0.33
TACR1 P25103 1/20 0.31
SLC6A1 P30531 2/20 0.31
HRH3 Q9Y5N1 2/20 0.30
OGFRL1 Q5TC84 1/20 0.30

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
SCHEMBL7882058 0.85 ACE (0.38) ACELTA4HTACR1SLC6A1
SCHEMBL28031439 0.76 GABRR1 (0.31)
SCHEMBL18602953 0.72
SCHEMBL29952267 0.72 ACE (0.40) ACELTA4HTACR1HRH3OGFRL1
SCHEMBL29952365 0.72 ACE (0.40) ACELTA4HTACR1HRH3OGFRL1
SCHEMBL28683755 0.72 ACE (0.39) ACELTA4HHRH3
SCHEMBL10814989 0.71 LMNA (0.30)
SCHEMBL25021692 0.71 CHRM5 (0.31)
SCHEMBL500406 0.71 ALDH1A1 (0.48) HRH3
SCHEMBL6809998 0.71 DPP4 (0.36) ACELTA4H

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
EP-0648204-B1 AMINO DEOXYALDITOL LIPOPHILIC DERIVATIVES FOR USE IN COSMETICS, COSMETIC COMPOSITIONS CONTAINING SAME AND NOVEL ALKYL CARBAMATES OREAL (FR) 1998-11-18 EP disclosed