SCHEMBL3600967

SCHEMBL3600967

CC(Cc1cn(S(=O)(=O)c2ccccc2Br)c2ccccc12)N(C)C

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 20/20 0.62
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
HTR1A P08908 1/20 0.46
DRD2 P14416 1/20 0.46
HTR1D P28221 1/20 0.46
HTR1B P28222 1/20 0.46
HTR1F P30939 1/20 0.46
HTR7 P34969 1/20 0.46
DRD3 P35462 1/20 0.46

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
SCHEMBL3587283 0.81 HTR6 (0.72) HTR6HTR1ADRD2HTR1DHTR1B
SCHEMBL947647 0.80 HTR6 (0.74) HTR6CYP3A4CYP2D6
SCHEMBL949279 0.79 HTR6 (0.72) HTR6CYP3A4CYP2D6
SCHEMBL5330866 0.77 HTR6 (0.50) HTR6CYP3A4CYP2D6
SCHEMBL3585571 0.77 HTR6 (1.00) HTR6
SCHEMBL5262967 0.76 HTR6 (0.49) HTR6
SCHEMBL946875 0.74 HTR6 (1.00) HTR6CYP3A4CYP2D6
SCHEMBL5231993 0.73 HTR6 (0.82) HTR6CYP3A4CYP2D6
Hydrochloric Acid SCHEMBL946247 0.73 HTR6 (0.98) HTR6CYP3A4CYP2D6
SCHEMBL3596183 0.72 HTR6 (0.69) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7649097-B2 Tetracyclic arylsulfonyl indoles having serotonin receptor affinity useful as therapeutic agents, process for their preparation and pharmaceutical compositions containing them SUVEN LIFE SCIENCES LIMITED (IN) 2010-01-19 US disclosed
EP-1523486-B1 TETRACYCLIC ARYLSULFONYL INDOLES HAVING SEROTONIN RECEPTOR AFFINITY SUVEN LIFE SCIENCES LTD (IN) 2007-11-07 EP disclosed
US-20050203154-A1 Novel tetracyclic arylsulfonyl indoles having serotonin receptor affinity useful as therapeutic agents, process for their preparation and pharmaceutical compositions containing them SUVEN LIFE SCIENCES LIMITED (IN) 2005-09-15 US 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 (1 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-20050203154-A1 Novel tetracyclic arylsulfonyl indoles having serotonin receptor affinity useful as therapeutic agents, process for their preparation and pharmaceutical compositions containing them TPH1, HTR1A, HTR7 HTR6 7/4885CYP3A4 139/4885CYP2D6 74/4885

“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.