SCHEMBL27771127

SCHEMBL27771127

C=CC(c1cccnc1)S(=O)(=O)n1ccc2c(Br)cccc21

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ HTR6 P50406 2/20 0.32
▸ MEN1 O00255 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ RXFP1 Q9HBX9 1/20 0.31
▸ CYP3A4 P08684 1/20 0.30
▸ CYP2D6 P10635 1/20 0.30

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
SCHEMBL27771257 0.87 HDAC3 (0.34) HTR6
SCHEMBL27750201 0.81 HTR6 (0.39) HTR6KMT2ACYP3A4CYP2D6
SCHEMBL28777651 0.80 HTR6 (0.34) HTR6CYP3A4CYP2D6
SCHEMBL27750242 0.78 HTR6 (0.35) HTR6
SCHEMBL27771191 0.78 HTR6 (0.53) HTR6CYP3A4CYP2D6
SCHEMBL3610149 0.73 HTR6 (0.51) HTR6
SCHEMBL27771123 0.72 HTR6 (0.39) HTR6CYP3A4CYP2D6
SCHEMBL27723333 0.71 — —
SCHEMBL28781859 0.69 HTR6 (0.52) HTR6
SCHEMBL27771126 0.69 CYP2D6 (0.36) MEN1KMT2ACYP3A4CYP2D6

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
CN-101484420-A Indoles as 5-HT 6 modulators BIOVITRUM AB PUBL (SE) 2009-07-15 — — CN disclosed
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