SCHEMBL5330251

SCHEMBL5330251

CC(Sc1cn(S(=O)(=O)c2ccc(F)cc2)c2ccccc12)N(C)C

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ HTR6 P50406 16/20 0.50
▸ CYP3A4 P08684 2/20 0.50
▸ CYP2D6 P10635 2/20 0.50
▸ HTR1A P08908 1/20 0.43
▸ DRD2 P14416 1/20 0.43
▸ HTR1D P28221 1/20 0.43
▸ HTR1B P28222 1/20 0.43
▸ HTR1F P30939 1/20 0.43
▸ HTR7 P34969 1/20 0.43
▸ DRD3 P35462 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ UBE2N P61088 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ ALDH3A1 P30838 1/20 0.41
▸ TNFSF11 O14788 1/20 0.41

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
SCHEMBL5336517 0.90 HTR6 (0.58) HTR6HTR1ADRD2HTR1DHTR1B
SCHEMBL5330258 0.89 KDM4E (0.55) HTR6HTR1ADRD2HTR1DHTR1B
SCHEMBL5330295 0.88 HTR6 (0.54) HTR6CYP3A4CYP2D6HTR1ADRD2
SCHEMBL5334191 0.88 HTR6 (0.45) HTR6CYP3A4CYP2D6
SCHEMBL5331226 0.86 HTR6 (0.57) HTR6HTR1ADRD2HTR1DHTR1B
SCHEMBL5332557 0.85 HTR6 (0.46) HTR6CYP3A4HTR1A
SCHEMBL5331272 0.84 HTR6 (0.53) HTR6CYP3A4CYP2D6
SCHEMBL5330297 0.83 HTR6 (0.52) HTR6CYP3A4CYP2D6HTR1ADRD2
SCHEMBL5327720 0.82 HTR6 (0.53) HTR6CYP3A4CYP2D6
SCHEMBL5330101 0.82 HTR6 (0.51) HTR6CYP3A4CYP2D6

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-2007020653-A1 THIOETHER DERIVATIVES AS FUNCTIONAL 5-HT6 LIGANDS SUVEN LIFE SCIENCES LIMITED (IN) 2007-02-22 — — WO disclosed
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