SCHEMBL1063247

SCHEMBL1063247

COc1ccc(C)cc1S(=O)(=O)Nc1cc(-c2ccc(N)nc2)c2occc2c1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.54
ALPL P05186 6/20 0.50
RECQL P46063 1/20 0.47
ALDH1A1 P00352 2/20 0.46
GAA P10253 1/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
LMNA P02545 3/20 0.46
THRB P10828 1/20 0.46
HPGD P15428 1/20 0.45
MAPT P10636 1/20 0.44
BRD4 O60885 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42

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
SCHEMBL1059034 0.84 RECQL (0.62) HTR6ALPLRECQLALDH1A1GAA
Trifluoroacetic Acid SCHEMBL1060391 0.80 ALPL (0.55) HTR6ALPLRECQLALDH1A1GAA
SCHEMBL1065628 0.78 HTR6 (0.64) HTR6ALPLRECQLALDH1A1GAA
Hydrochloric Acid SCHEMBL1061043 0.73 RECQL (0.63) HTR6ALPLRECQLALDH1A1GAA
Hydrochloric Acid SCHEMBL1060310 0.73 HTR6 (0.58) HTR6ALPLRECQLALDH1A1GAA
SCHEMBL1062567 0.72 HTR6 (0.69) HTR6ALPLRECQLMEN1KMT2A
SCHEMBL1062669 0.71 HTR6 (0.56) HTR6ALPLRECQLALDH1A1GAA
SCHEMBL3958865 0.70 HTR6 (1.00) HTR6ALPLRECQLALDH1A1GAA
SCHEMBL3624331 0.70 HTR6 (0.64) HTR6ALPLRECQLALDH1A1GAA
SCHEMBL1059962 0.70 HTR6 (0.54) HTR6RECQLALDH1A1MEN1KMT2A

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4739230-B2 2011-08-03 JP claimed
US-20110015185-A1 Benzofuran Compounds BIOVITRUM AB (SE) 2011-01-20 US claimed
JP-2007514745-A 2007-06-07 JP claimed
US-20060287291-A1 Compounds PROXIMAGEN NEUROSCIENCE PLC (GB) 2006-12-21 US claimed
EP-1694663-A1 NOVEL BENZOFURAN DERIVATIVES, WHICH CAN BE USED IN PROPHYLAXIS OR TREATMENT OF 5-HT6 RECEPTOR-RELATED DISORDER Biovitrum Aktiebolag (SE) 2006-08-30 EP claimed
WO-2005058858-A1 NOVEL BENZOFURAN DERIVATIVES, WHICH CAN BE USED IN PROPHYLAXIS OR TREATMENT OF 5-HT6 RECEPTOR-RELATED DISORDER BIOVITRUM AB (SE) 2005-06-30 WO claimed
US-20110015185-A1 Benzofuran Compounds BIOVITRUM AB (SE) 2011-01-20 US disclosed
US-7820675-B2 Benzofuran compounds BIOVITRUM AB (SE) 2010-10-26 US disclosed
US-20060287291-A1 Compounds PROXIMAGEN NEUROSCIENCE PLC (GB) 2006-12-21 US disclosed
EP-1694663-A1 NOVEL BENZOFURAN DERIVATIVES, WHICH CAN BE USED IN PROPHYLAXIS OR TREATMENT OF 5-HT6 RECEPTOR-RELATED DISORDER Biovitrum Aktiebolag (SE) 2006-08-30 EP disclosed
WO-2005058858-A1 NOVEL BENZOFURAN DERIVATIVES, WHICH CAN BE USED IN PROPHYLAXIS OR TREATMENT OF 5-HT6 RECEPTOR-RELATED DISORDER BIOVITRUM AB (SE) 2005-06-30 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060287291-A1 Compounds HTR6, HTR1B, HTR1A HTR6 1/4885ALPL 4692/4885RECQL 1512/4885
US-20110015185-A1 Benzofuran Compounds HTR6, HTR1F, HTR1A HTR6 1/4885ALPL 4669/4885RECQL 1091/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.