SCHEMBL8338633

SCHEMBL8338633

COc1ccccc1-c1cc(S(=O)(=O)Nc2ccc(C(F)(F)F)c(O[C@@H]3CCN(C)C3)c2)sc1Cl

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 19/20 0.62
HTR1A P08908 1/20 0.38
HTR1D P28221 1/20 0.38
HTR1B P28222 1/20 0.38
HTR2A P28223 1/20 0.38
HTR2C P28335 1/20 0.38
HTR1E P28566 1/20 0.38
HTR7 P34969 1/20 0.38
HTR2B P41595 1/20 0.38
HTR3A P46098 1/20 0.38
HTR5A P47898 1/20 0.38

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
SCHEMBL6826102 0.93 UTS2R (0.57) UTS2R
SCHEMBL6826104 0.93 UTS2R (0.57) UTS2R
SCHEMBL8338940 0.92 UTS2R (0.62) UTS2R
SCHEMBL8338931 0.92 UTS2R (0.57) UTS2R
SCHEMBL6828746 0.91 UTS2R (0.55) UTS2R
SCHEMBL6828751 0.91 UTS2R (0.55) UTS2R
SCHEMBL6828755 0.90 UTS2R (0.61) UTS2R
SCHEMBL6828760 0.90 UTS2R (0.61) UTS2R
SCHEMBL8339297 0.88 UTS2R (0.55) UTS2RHTR2CHTR2B
SCHEMBL6830661 0.88 UTS2R (0.59) UTS2R

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
WO-2004043368-A2 SULFONAMIDES SMITHKLINE BEECHAM CORPORATION (US) 2004-05-27 WO disclosed