SCHEMBL4049262

SCHEMBL4049262

CN1CCN(Cc2cn(S(=O)(=O)c3ccccc3)c3c(Br)cccc23)CC1

nearest known ligand 0.70

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 20/20 0.70
CYP3A4 P08684 2/20 0.59
CYP2D6 P10635 2/20 0.59

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
SCHEMBL4047425 0.91 HTR6 (0.70) HTR6CYP3A4CYP2D6
SCHEMBL4052932 0.90 HTR6 (0.70) HTR6CYP3A4CYP2D6
SCHEMBL4052627 0.89 HTR6 (0.71) HTR6CYP3A4CYP2D6
SCHEMBL947701 0.82 HTR6 (1.00) HTR6CYP3A4CYP2D6
SCHEMBL947185 0.79 HTR6 (0.81) HTR6CYP3A4CYP2D6
SCHEMBL947115 0.79 HTR6 (1.00) HTR6CYP3A4CYP2D6
SCHEMBL3204417 0.78 HTR6 (1.00) HTR6CYP3A4CYP2D6
SCHEMBL946875 0.76 HTR6 (1.00) HTR6CYP3A4CYP2D6
SCHEMBL4047390 0.76 HTR6 (0.68) HTR6
Hydrochloric Acid SCHEMBL946247 0.76 HTR6 (0.98) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101166746-B Process for preparing substituted benzothiazinoindoles SUVEN LIFE SCIENCES LTD 2011-09-28 CN disclosed
EP-1856132-B1 PROCESS FOR PREPARING SUBSTITUTED BENZOTHIAZINOINDOLES SUVEN LIFE SCIENCES LTD (IN) 2009-04-01 EP disclosed
US-20080119646-A1 Process for Preparing Substituted Benzothiazinoindoles SUVEN LIFE SCIENCES LIMITED (IN) 2008-05-22 US disclosed
CN-101166746-A Process for preparing substituted benzothiazinoindoles SUVEN LIFE SCIENCES LTD (IN) 2008-04-23 CN 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-20080119646-A1 Process for Preparing Substituted Benzothiazinoindoles C5, CYP8B1, CBR1 HTR6 698/4885CYP3A4 102/4885CYP2D6 152/4885

“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.