SCHEMBL9547017

SCHEMBL9547017

O=C(CC(=O)C(=O)OC(=O)C(O)C(O)C(=O)O)OC(=O)C(O)C(O)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.39

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
SCHEMBL9149983 0.86 TSHR (0.48) TSHR
SCHEMBL28775765 0.81 TSHR (0.36) TSHR
SCHEMBL27364734 0.79 TSHR (0.56) TSHR
SCHEMBL94759 0.77 TSHR (0.48) TSHR
Ammonia Solution, Strong SCHEMBL11116924 0.77 TSHR (0.53) TSHR
SCHEMBL27623112 0.77 TSHR (0.53) TSHR
SCHEMBL7035397 0.75 TSHR (0.46) TSHR
SCHEMBL27625179 0.75 TSHR (0.46) TSHR
SCHEMBL27605067 0.75 TSHR (0.46) TSHR
SCHEMBL22609753 0.74 TSHR (0.50) TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0551390-A1 POLYHYDROXY FATTY ACID AMIDES IN SOIL RELEASE AGENT-CONTAINING DETERGENT COMPOSITIONS. PROCTER & GAMBLE (US) 1993-07-21 EP disclosed
WO-1992006152-A1 POLYHYDROXY FATTY ACID AMIDES IN SOIL RELEASE AGENT-CONTAINING DETERGENT COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1992-04-16 WO disclosed