SCHEMBL8583148

SCHEMBL8583148

CON=C(SC)C(=O)OC

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.35

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
SCHEMBL8583145 1.00 ALDH1A1 (0.35) ALDH1A1
SCHEMBL11025626 0.71
SCHEMBL17272640 0.70 ALDH1A1 (0.39) ALDH1A1
SCHEMBL10241554 0.69
SCHEMBL27866566 0.69 ALDH1A1 (0.38) ALDH1A1
SCHEMBL10020203 0.69
SCHEMBL9519903 0.67 ALDH1A1 (0.41) ALDH1A1
SCHEMBL9519914 0.67 ALDH1A1 (0.41) ALDH1A1
SCHEMBL9519897 0.67 ALDH1A1 (0.41) ALDH1A1
SCHEMBL3103329 0.67

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
WO-1999067209-A1 HYDROXIMIC ACID DERIVATIVES, PROCESS FOR THEIR PREPARATION AND INTERMEDIATES THEREFOR HOECHST SCHERING AGREVO GMBH (DE) 1999-12-29 WO disclosed