SCHEMBL8577229

SCHEMBL8577229

CCCSCCC.CCP(O)(O)=S

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALPG P10696 1/20 0.38
TDP1 Q9NUW8 1/20 0.35
LPAR2 Q9HBW0 3/20 0.30
LPAR3 Q9UBY5 3/20 0.30

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
SCHEMBL432883 0.78
SCHEMBL7954702 0.78
Hydrochloric Acid SCHEMBL10750098 0.75
SCHEMBL42070 0.74
Alcohol SCHEMBL28630890 0.72 ALDH1A1 (0.46) TDP1
Hydrochloric Acid SCHEMBL25414584 0.71
SCHEMBL12570288 0.71 TDP1 (0.40) TDP1
SCHEMBL7963310 0.71
SCHEMBL11454029 0.71
SCHEMBL10122625 0.71 TDP1 (0.40) TDP1

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
US-5719310-A PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1998-02-17 US disclosed
US-5610122-A PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1997-03-11 US disclosed