SCHEMBL4067235

SCHEMBL4067235

O=S(=O)(c1ccc2cc(-c3ccc(F)cc3)ccc2c1)c1ccccc1-c1cnccn1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 1/20 0.41
ALOX5AP P20292 4/20 0.41
FEN1 P39748 4/20 0.41
HSD11B1 P28845 1/20 0.39
NAMPT P43490 1/20 0.39
HTR2A P28223 2/20 0.38
MMP1 P03956 1/20 0.37
MMP2 P08253 1/20 0.37
MMP3 P08254 1/20 0.37
MMP9 P14780 1/20 0.37
MMP12 P39900 1/20 0.37
MMP13 P45452 1/20 0.37
MMP14 P50281 1/20 0.37
GAA P10253 2/20 0.37
EDNRB P24530 1/20 0.36
EDNRA P25101 1/20 0.36
GRM5 P41594 2/20 0.36
SIRT2 Q8IXJ6 1/20 0.36
HTR2C P28335 1/20 0.36
PTGS2 P35354 2/20 0.36

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
SCHEMBL4075567 0.76 HTR2A (0.50) HSD11B1HTR2AMMP1MMP2MMP3
SCHEMBL4069835 0.74 NOTUM (0.44) HSD11B1MMP1MMP2MMP3MMP9
SCHEMBL4073428 0.74 PTGS2 (0.48) HSD11B1HTR2AMMP1MMP2MMP3
SCHEMBL4066061 0.73 KDM4E (0.49) PIK3CAHTR2APTGS2CA1CA2
SCHEMBL4070632 0.72 MMP1 (0.43) HSD11B1HTR2AMMP1MMP2MMP3
SCHEMBL4069804 0.72 MAOA (0.40) PIK3CANAMPTMMP1MMP2MMP3
SCHEMBL4076387 0.71 CA2 (0.50) HTR2AMMP1MMP2MMP3MMP9
SCHEMBL4071275 0.71 MMP1 (0.42) HSD11B1HTR2AMMP1MMP2MMP3
SCHEMBL4069576 0.71 HSD11B1 (0.46) HSD11B1HTR2AMMP1MMP2MMP3
SCHEMBL4250049 0.70 MMP1 (0.41) HSD11B1HTR2AMMP1MMP2MMP3

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-7592456-B2 Arylsulfonylnaphthalene derivatives as 5HT2A antagonists MERCK SHARP & DOHME LIMITED (GB) 2009-09-22 US claimed
US-20070281952-A1 Arylsulfonylnaphthalene Derivatives As 5Ht2a Antagonists MERCK SHARPE & DOHME LIMITED (GB) 2007-12-06 US claimed
US-7592456-B2 Arylsulfonylnaphthalene derivatives as 5HT2A antagonists MERCK SHARP & DOHME LIMITED (GB) 2009-09-22 US disclosed
EP-1824817-B1 ARYLSULFONYLNAPHTHALENE DERIVATIVES AS 5HT2A ANTAGONISTS MERCK SHARP & DOHME (GB) 2009-02-04 EP disclosed
US-20070281952-A1 Arylsulfonylnaphthalene Derivatives As 5Ht2a Antagonists MERCK SHARPE & DOHME LIMITED (GB) 2007-12-06 US disclosed
EP-1824817-A1 ARYLSULFONYLNAPHTHALENE DERIVATIVES AS 5HT2A ANTAGONISTS MERCK SHARP & DOHME LTD. (GB) 2007-08-29 EP disclosed
WO-2006059149-A1 ARYLSULFONYLNAPHTHALENE DERIVATIVES AS 5HT2A ANTAGONISTS MERCK SHARP & DOHME LIMITED (GB) 2006-06-08 WO 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-20070281952-A1 Arylsulfonylnaphthalene Derivatives As 5Ht2a Antagonists HTR2A, HTR2C, HTR1A PIK3CA 4160/4885ALOX5AP 592/4885FEN1 3033/4885

“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.