SCHEMBL27468574

SCHEMBL27468574

O=S(=O)(Cl)c1cc[c]c(C(F)(F)F)c1

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.35
HSD17B10 Q99714 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
TRPV4 Q9HBA0 1/20 0.33

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
SCHEMBL1459816 0.81 KIF11 (0.40) ALDH1A1HSD17B10
SCHEMBL28813873 0.74 ALDH1A1 (0.39) ALDH1A1HSD17B10TDP1
SCHEMBL262756 0.73 NT5E (0.30)
SCHEMBL27980146 0.72 ALDH1A1 (0.38) ALDH1A1HSD17B10TDP1
SCHEMBL101479 0.71 PDK2 (0.31)
SCHEMBL7312262 0.70 TSHR (0.51) ALDH1A1HSD17B10
SCHEMBL20838953 0.69 ALDH1A1 (0.35) ALDH1A1HSD17B10TDP1
SCHEMBL149760 0.69 TSHR (0.37) ALDH1A1
SCHEMBL6536620 0.68 KIF11 (0.42) ALDH1A1HSD17B10TDP1TRPV4
SCHEMBL27879710 0.68

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
CN-1130355-C Thienyl-, Furyl-, Pyrrolyl- and biphenylsulfonamides and derivatives thereof that modulate the activity of endothelin TEXAS BIOTECHNOLOGY CORP (US) 2003-12-10 CN disclosed
CN-1184470-A Thienyl-, Furyl-, Pyrrolyl- and biphenylsulfonamides and derivatives thereof that modulate the activity of endothelin TEXAS BIOTECHNOLOGY CORP (US) 1998-06-10 CN disclosed