Sugi Predict

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SCHEMBL4398501

SCHEMBL4398501

Cc1ccc2c(c1)COC(=O)N2C1CCN(S(=O)(=O)c2ccc3ncc(C)cc3c2)CC1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ HTR6 P50406 7/20 0.46
▸ LMNA P02545 2/20 0.42
▸ MAPT P10636 2/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.39
▸ EPHX2 P34913 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
SCHEMBL4394298 0.92 HTR6 (0.44) HTR6LMNAMAPTMEN1ALDH1A1
SCHEMBL4397615 0.92 HTR6 (0.49) HTR6LMNAMAPTALDH1A1
SCHEMBL4399061 0.91 HTR6 (0.56) HTR6LMNA
SCHEMBL4394478 0.89 HTR6 (0.56) HTR6LMNAMAPTMEN1ALDH1A1
SCHEMBL3142474 0.85 HTR6 (0.52) HTR6MEN1ALDH1A1KMT2A
SCHEMBL4399483 0.84 HTR6 (0.61) HTR6LMNAMAPTMEN1ALDH1A1
SCHEMBL3144543 0.84 HTR6 (0.56) HTR6LMNAMAPTMEN1ALDH1A1
SCHEMBL4392195 0.84 HTR6 (0.44) HTR6LMNAMAPTMEN1ALDH1A1
SCHEMBL3153162 0.83 HTR6 (0.48) HTR6LMNAMAPTMEN1ALDH1A1
SCHEMBL3142862 0.82 HTR6 (0.64) HTR6ALDH1A1

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
EP-1648886-B1 BENZOXAZINONE-DERIVED SULFONAMIDE COMPOUNDS, THEIR PREPARATION AND USE AS MEDICAMENTS ESTEVE LABOR DR (ES) 2009-12-09 — — EP claimed