SCHEMBL4015622

SCHEMBL4015622

O=S(=O)(c1ccc(C=Cc2ccc(F)cc2)cc1)c1ncccc1C(O)C(F)(F)F

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 8/20 0.52
KCNH2 Q12809 5/20 0.52
HTR2C P28335 3/20 0.52
CYP2D6 P10635 1/20 0.43
NFE2L2 Q16236 4/20 0.39
COMT P21964 2/20 0.38
NAMPT P43490 1/20 0.37
PTGS2 P35354 1/20 0.36
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.35
RAB9A P51151 1/20 0.35

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
SCHEMBL4015619 1.00 HTR2A (0.52) HTR2AKCNH2HTR2CCYP2D6NFE2L2
SCHEMBL4019652 0.87 HTR2A (0.66) HTR2AKCNH2HTR2CCYP2D6NFE2L2
SCHEMBL4019650 0.87 HTR2A (0.66) HTR2AKCNH2HTR2CCYP2D6NFE2L2
SCHEMBL4017235 0.84 HTR2A (0.53) HTR2AKCNH2HTR2CCYP2D6NFE2L2
SCHEMBL4017231 0.84 HTR2A (0.53) HTR2AKCNH2HTR2CCYP2D6NFE2L2
SCHEMBL4016499 0.77 HTR2A (0.57) HTR2AKCNH2HTR2CNFE2L2COMT
SCHEMBL4016502 0.77 HTR2A (0.57) HTR2AKCNH2HTR2CNFE2L2COMT
SCHEMBL4016838 0.77 KMT2A (0.61) HTR2AKCNH2HTR2CCYP2D6NFE2L2
SCHEMBL4021156 0.77 HTR2A (0.57) HTR2AKCNH2HTR2CNFE2L2COMT
SCHEMBL4015055 0.77 KMT2A (0.61) HTR2AKCNH2HTR2CCYP2D6NFE2L2

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.