SCHEMBL7107980

SCHEMBL7107980

COc1cccc2c1/C(=N/O)CN(CCCCl)S2(=O)=O

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 6/20 0.38
DRD2 P14416 4/20 0.34
ELANE P08246 4/20 0.34
DRD4 P21917 1/20 0.34
DRD5 P21918 1/20 0.34
DRD3 P35462 1/20 0.34
HTR1A P08908 3/20 0.34
HTR2A P28223 3/20 0.34
HTR6 P50406 3/20 0.34
TDP1 Q9NUW8 1/20 0.33
ATM Q13315 1/20 0.33
KCNH2 Q12809 3/20 0.32
HRH3 Q9Y5N1 3/20 0.32
KCNA5 P22460 1/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
ALDH1A1 P00352 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2D6 P10635 1/20 0.32

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
SCHEMBL7107985 1.00 HTR7 (0.38) HTR7DRD2ELANEDRD4DRD5
SCHEMBL6991277 0.86 TDP1 (0.42) HTR7DRD2ELANEDRD4DRD5
SCHEMBL7109614 0.79 HTR7 (0.52) HTR7DRD2DRD4DRD3HTR1A
SCHEMBL7104565 0.79 HTR7 (0.44) HTR7DRD2DRD4DRD5DRD3
SCHEMBL7104560 0.79 HTR7 (0.44) HTR7DRD2DRD4DRD5DRD3
SCHEMBL7109613 0.79 HTR7 (0.52) HTR7DRD2DRD4DRD3HTR1A
SCHEMBL7001209 0.78 TDP1 (0.44) ELANETDP1ATMMEN1KMT2A
SCHEMBL7001206 0.78 TDP1 (0.44) ELANETDP1ATMMEN1KMT2A
Ethylene SCHEMBL6993539 0.76 TDP1 (0.35) HTR7DRD2ELANEDRD4DRD5
SCHEMBL7103149 0.76 HTR7 (0.38) HTR7DRD2ELANEDRD4DRD5

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 6 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
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 HTR7 24/4885DRD2 402/4885ELANE 3749/4885

“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.