SCHEMBL9711291

SCHEMBL9711291

Cc1cc(S(=O)O)cc(C)c1F

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SOS1 Q07889 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
SCHEMBL9711260 0.98 SOS1 (0.30) SOS1
SCHEMBL9711255 0.74 SOS1 (0.33) SOS1
SCHEMBL6885886 0.73 CA1 (0.36)
SCHEMBL5270799 0.72 ALDH1A1 (0.41)
SCHEMBL10344609 0.72 CES2 (0.42)
SCHEMBL7170546 0.71 ALDH1A1 (0.37)
SCHEMBL1583684 0.70 CES2 (0.40)
SCHEMBL29590125 0.70 CES2 (0.40)
SCHEMBL6890747 0.70 CA1 (0.33)
SCHEMBL28831953 0.70 HDAC1 (0.42)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5153227-A Treatment of diabetes and galactosemia complications IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-10-06 US disclosed
EP-0304190-B1 (ARYLSULPHONYL)NITROMETHANES, PROCESS FOR THEIR PREPARATION AND USE IN PHARMACEUTICAL COMPOSITIONS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-07-08 EP disclosed
EP-0304190-A1 (Arylsulphonyl)nitromethanes, process for their preparation and use in pharmaceutical compositions IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1989-02-22 EP disclosed