SCHEMBL8779774

SCHEMBL8779774

O=S(=O)(Cl)c1ncncn1

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36
HSD17B10 Q99714 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
HSP90AA1 P07900 1/20 0.35
CDC25B P30305 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
SCHEMBL11500740 0.78 ALDH1A1 (0.36) ALDH1A1HSD17B10TDP1
SCHEMBL569903 0.77 HSP90AA1 (0.38) HSP90AA1
SCHEMBL427634 0.74 TDP1 (0.43) ALDH1A1HSD17B10TDP1HSP90AA1CDC25B
SCHEMBL7558103 0.72 HSP90AA1 (0.35) HSP90AA1
SCHEMBL21247994 0.72 HSP90AA1 (0.41) HSP90AA1
SCHEMBL2333580 0.72 HSP90AA1 (0.41) HSD17B10HSP90AA1
SCHEMBL4433500 0.72 LMNA (0.38) HSP90AA1
SCHEMBL2050078 0.70 ALDH1A1 (0.31) ALDH1A1HSD17B10TDP1
SCHEMBL27990009 0.70 HSP90AA1 (0.33) HSP90AA1
Hydrogen Sulfide SCHEMBL8036769 0.70 HSP90AA1 (0.33) HSP90AA1

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
EP-0770599-A1 PROCESS FOR THE PREPARATION OF AROMATIC OR HETEROAROMATIC SULFONYL HALIDES SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 1997-05-02 EP disclosed