SCHEMBL7869641

SCHEMBL7869641

CCSC(=O)OCOC(=O)C(C)(C)C(=O)OCOC(=O)SCC

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33

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
SCHEMBL1507155 0.88 PRKCA (0.35) ALDH1A1
SCHEMBL7715352 0.85 CYP4F2 (0.33) ALDH1A1
SCHEMBL391974 0.78 ALDH1A1 (0.33) ALDH1A1
SCHEMBL990499 0.77 ALDH1A1 (0.44) ALDH1A1
SCHEMBL1507260 0.77 NAAA (0.39) ALDH1A1
SCHEMBL9893495 0.74 HDAC3 (0.33)
SCHEMBL7715573 0.74 ACHE (0.41) ALDH1A1
SCHEMBL19142615 0.74
SCHEMBL15246923 0.73 ALDH1A1 (0.34) ALDH1A1
SCHEMBL21332795 0.73 ALDH1A1 (0.44) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2001056358-A2 ENHANCED PROPERTIED PESTICIDES ROHM AND HAAS COMPANY (US) 2001-08-09 WO disclosed