Tetrahydrothiophene

Tetrahydrothiophene

SCHEMBL8629865

C1CCSC1.CCC(C)=O

nearest known ligand 0.56

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Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.56
TDP1 Q9NUW8 2/20 0.56
FFAR3 O14843 1/20 0.33
TRPA1 O75762 1/20 0.32

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
Propionic Acid SCHEMBL27494376 0.83 FFAR3 (0.56) ALDH1A1TDP1FFAR3
Tetrahydrothiophene SCHEMBL9620648 0.82
Acetone SCHEMBL7399782 0.79 LMNA (0.40)
Tetrahydrothiophene SCHEMBL9158780 0.79
Acetone SCHEMBL28864865 0.79 LMNA (0.40)
Acetone SCHEMBL7399779 0.79 LMNA (0.40)
Cyclooctane SCHEMBL17142032 0.78 ALDH1A1 (0.77) ALDH1A1TDP1FFAR3TRPA1
Cyclohexane SCHEMBL1573965 0.78 ALDH1A1 (0.77) ALDH1A1TDP1FFAR3TRPA1
Acetic Acid SCHEMBL28746199 0.77 FFAR3 (0.44) FFAR3
Acetic Acid SCHEMBL8037750 0.77 FFAR3 (0.44) FFAR3

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-0284803-B1 Novel soluble polymidesiloxanes and methods for their preparation and use OCCIDENTAL CHEM CO (US) 1998-07-15 EP disclosed
US-4385196-A RECOVERY OF SOLVENT IN DRYING/STRIPPING COLUMN PHILLIPS PETROLEUM COMPANY (US) 1983-05-24 US disclosed