SCHEMBL4014140

SCHEMBL4014140

COC(=O)c1cccnc1S(=O)(=O)c1ccc(/C=C/c2ccc(F)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 8/20 0.45
KCNH2 Q12809 4/20 0.45
HTR2C P28335 3/20 0.43
EGFR P00533 1/20 0.43
CYP2D6 P10635 1/20 0.42
SLC6A4 P31645 1/20 0.41
SLC6A3 Q01959 1/20 0.41
NAMPT P43490 1/20 0.41
COMT P21964 2/20 0.40
DHODH Q02127 1/20 0.39
SNCA P37840 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39
ALOX12 P18054 1/20 0.39
KMT2A Q03164 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39

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
SCHEMBL4014145 1.00 HTR2A (0.45) HTR2AKCNH2HTR2CEGFRCYP2D6
SCHEMBL4015836 0.88 HTR2A (0.45) HTR2AKCNH2HTR2CCYP2D6ALDH1A1
SCHEMBL4015834 0.88 HTR2A (0.45) HTR2AKCNH2HTR2CCYP2D6ALDH1A1
SCHEMBL4012497 0.87 HTR2A (0.48) HTR2AKCNH2HTR2CEGFRCYP2D6
SCHEMBL4012492 0.87 HTR2A (0.48) HTR2AKCNH2HTR2CEGFRCYP2D6
SCHEMBL4015634 0.85 HTR2A (0.51) HTR2AKCNH2HTR2CEGFRCYP2D6
SCHEMBL4015639 0.85 HTR2A (0.51) HTR2AKCNH2HTR2CEGFRCYP2D6
SCHEMBL4019914 0.84 HTR2A (0.53) HTR2AKCNH2HTR2CEGFRCYP2D6
SCHEMBL4164182 0.84 HTR2A (0.48) HTR2AKCNH2HTR2CEGFRCYP2D6
SCHEMBL4164176 0.84 HTR2A (0.48) HTR2AKCNH2HTR2CEGFRCYP2D6

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-20080280956-A1 Heteroarylsulfonyl Stilbenes as 5-Ht2a Antagonists GILLIGAN MYRA 2008-11-13 US claimed
EP-1858852-B1 HETEROARYLSULFONYL STILBENES AS 5-HT2A ANTAGONISTS MERCK SHARP & DOHME (GB) 2009-07-01 EP disclosed
US-20080280956-A1 Heteroarylsulfonyl Stilbenes as 5-Ht2a Antagonists GILLIGAN MYRA 2008-11-13 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-20080280956-A1 Heteroarylsulfonyl Stilbenes as 5-Ht2a Antagonists HTR2A, HTR2B, HTR2C HTR2A 1/4885KCNH2 1308/4885HTR2C 3/4885

“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.