SCHEMBL6988907

SCHEMBL6988907

COc1cccc2c1C(O)CN(CCCl)S2(=O)=O

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 2/20 0.36
HCRTR2 O43614 9/20 0.35
HCRTR1 O43613 8/20 0.35
CYP3A4 P08684 1/20 0.35
ELANE P08246 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.33
HTR7 P34969 1/20 0.33
POLL Q9UGP5 1/20 0.33

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
SCHEMBL7000061 0.93 HTR1A (0.37) HTR1AHCRTR2HCRTR1CYP3A4ELANE
SCHEMBL6995519 0.92 HTR7 (0.37) HTR1AHCRTR2HCRTR1CYP3A4L3MBTL1
SCHEMBL7103167 0.85 HTR1A (0.36) HTR1AHCRTR2HCRTR1CYP3A4L3MBTL1
SCHEMBL7105922 0.79 HTR1A (0.37) HTR1AHCRTR2HCRTR1CYP3A4L3MBTL1
SCHEMBL6993469 0.78 DRD4 (0.44) HTR1ACYP3A4L3MBTL1HTR7
SCHEMBL7109579 0.78 HTR7 (0.37) HTR1AHCRTR2HCRTR1CYP3A4L3MBTL1
SCHEMBL6988175 0.77 HTR7 (0.42) HTR1AHTR7
SCHEMBL6994507 0.77 HTR7 (0.49) HTR1ACYP3A4HTR7
SCHEMBL6994254 0.77 HTR7 (0.47) HTR1AHTR7
SCHEMBL7110750 0.76 HCRTR1 (0.37) HTR1AHCRTR2HCRTR1L3MBTL1HTR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6664251-B2 Serotonin receptor antagonist; treating cardiovascular disorder DAIICHI SUNTORY PHARMA CO., LTD. (JP) 2003-12-16 US disclosed
US-20030078256-A1 Benzothiazine derivative SUNTORY LIMITED (JP) 2003-04-24 US disclosed
EP-0749967-B1 Substituted benzothiazine derivative SUNTORY LTD (JP) 2003-01-22 EP disclosed
US-6316442-B1 TREATMENT OF HEART DISEASE AND CEREBROVASCULAR DISTURBANCES SUNTORY LIMITED (JP) 2001-11-13 US disclosed
US-6001827-A Benzothiazine derivative SUNTORY LIMITED (JP) 1999-12-14 US disclosed
US-5874429-A ANTIISCHEMIC AGENTS; CEREBROVASCULAR DISORDERS; CIRCULATORY IDSORDERS SUNTORY LIMITED (JP) 1999-02-23 US disclosed
EP-0749967-A1 Substituted benzothiazine derivative SUNTORY LIMITED (JP) 1996-12-27 EP 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-20030078256-A1 Benzothiazine derivative TPH2, ADRB2, TPH1 HTR1A 7/4885HCRTR2 55/4885HCRTR1 286/4885

“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.