SCHEMBL27488685

SCHEMBL27488685

CC(C)C(O)C(C)(C)O.CCC(C)(O)C(C)(C)O

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.35
TRPA1 O75762 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
SCHEMBL16889148 0.79
SCHEMBL10297559 0.79
SCHEMBL16888849 0.79
SCHEMBL7128934 0.79
SCHEMBL1239430 0.79
SCHEMBL8529153 0.72 TSHR (0.39) TSHRTRPA1
Boric Acid SCHEMBL31405735 0.71 TSHR (0.33) TSHR
SCHEMBL7242507 0.69 TSHR (0.35) TSHR
SCHEMBL10773007 0.69 TRPA1 (0.45) TSHRTRPA1
SCHEMBL14401846 0.69 TRPA1 (0.45) TSHRTRPA1

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
CN-1195369-A Concentrated and stable fabric softening compositions PROCTER & GAMBLE (US) 1998-10-07 CN claimed