SCHEMBL3573067

SCHEMBL3573067

NCCc1ccc2c(S(=O)(=O)c3cccc(F)c3)c[nH]c2c1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ SLC6A2 P23975 1/20 0.46
▸ HTR6 P50406 7/20 0.45
▸ TAAR1 Q96RJ0 2/20 0.44
▸ HTR2A P28223 2/20 0.44
▸ TDO2 P48775 3/20 0.43
▸ MPO P05164 1/20 0.39
▸ TRPM8 Q7Z2W7 1/20 0.39
▸ HTR1A P08908 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ FEN1 P39748 1/20 0.38
▸ GRM5 P41594 1/20 0.37

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
SCHEMBL3572358 0.87 SLC6A2 (0.56) SLC6A2HTR6HTR2A
Hydrochloric Acid SCHEMBL3574473 0.85 SLC6A2 (0.55) SLC6A2HTR6HTR2A
SCHEMBL3567218 0.78 SLC6A2 (0.76) SLC6A2HTR6HTR2AMPOTRPM8
Hydrochloric Acid SCHEMBL3571084 0.77 SLC6A2 (0.74) SLC6A2HTR6HTR2AMPOTRPM8
SCHEMBL3577221 0.77 SLC6A2 (0.56) SLC6A2HTR6HTR2AHTR1AKMT2A
SCHEMBL30091129 0.77 TDO2 (0.52) HTR6HTR2ATDO2KMT2AFEN1
Hydrochloric Acid SCHEMBL3574630 0.76 SLC6A2 (0.55) SLC6A2HTR6HTR2AHTR1A
SCHEMBL3567564 0.74 SLC6A2 (0.44) SLC6A2HTR6HTR2A
SCHEMBL14469423 0.74 SLC6A2 (0.48) SLC6A2HTR2AKMT2A
SCHEMBL3579618 0.71 HTR2A (0.59) SLC6A2HTR6HTR2AHTR1A

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
US-7645752-B2 Sulfonyl substituted 1H-indoles as ligands for the 5-hydroxytryptamine receptors WYETH LLC (US) 2010-01-12 — — US claimed
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