SCHEMBL9463176

SCHEMBL9463176

C/C=C/C(=O)C(CCOC)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31
DDAH1 O94760 1/20 0.31

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
SCHEMBL9463182 1.00 ALDH1A1 (0.31) ALDH1A1DDAH1
SCHEMBL2634911 0.79 ALDH1A1 (0.41) ALDH1A1DDAH1
SCHEMBL13144525 0.78 CHRM1 (0.44)
SCHEMBL28075191 0.76 GABRR1 (0.45)
SCHEMBL28130520 0.73 CPB2 (0.41) ALDH1A1
SCHEMBL441261 0.73 ALDH1A1 (0.37) ALDH1A1DDAH1
SCHEMBL27974274 0.73 FFAR3 (0.35)
SCHEMBL28131142 0.72 GSR (0.47) ALDH1A1
SCHEMBL28131214 0.70 GSR (0.46) ALDH1A1
SCHEMBL28131140 0.70 GSR (0.46) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5177211-A Anti-platelet aggregation and anti-hypotensive ALTER, S.A. (ES) 1993-01-05 US disclosed
EP-0325187-B1 4-ALKYL-1, 4-DIHYDROPYRIDINES WITH PAF-ANTAGONIST ACTIVITY ALTER, S.A. (ES) 1992-11-11 EP disclosed
EP-0325187-A1 4-alkyl-1, 4-dihydropyridines with PAF-antagonist activity ALTER, S.A. (ES) 1989-07-26 EP disclosed