SCHEMBL4075239

SCHEMBL4075239

O=S(=O)(c1ccc2cc(-c3ccc(F)cc3)ccc2c1)c1ccccc1CCO

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 11/20 0.55
MMP9 P14780 10/20 0.55
MMP12 P39900 10/20 0.55
MMP1 P03956 7/20 0.55
MMP3 P08254 7/20 0.55
MMP13 P45452 7/20 0.55
MMP14 P50281 7/20 0.55
CYP2D6 P10635 1/20 0.52
MMP8 P22894 4/20 0.44
MMP16 P51512 4/20 0.44
HSD11B1 P28845 1/20 0.40
PTGDR2 Q9Y5Y4 5/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
ALB P02768 1/20 0.38
PIK3CG P48736 1/20 0.38

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
SCHEMBL5264611 0.83 MMP2 (0.52) MMP2MMP9MMP12MMP1MMP3
SCHEMBL4075567 0.80 HTR2A (0.50) MMP2MMP9MMP12MMP1MMP3
SCHEMBL3157307 0.80 CYP2D6 (0.80) MMP2MMP9MMP12MMP1MMP3
SCHEMBL3157305 0.80 CYP2D6 (0.80) MMP2MMP9MMP12MMP1MMP3
SCHEMBL4073428 0.78 PTGS2 (0.48) MMP2MMP9MMP12MMP1MMP3
SCHEMBL4074718 0.78 PTGS1 (0.38) MMP2MMP9MMP12MMP1MMP3
SCHEMBL4486237 0.77 HSD11B1 (0.51) MMP2MMP9MMP12MMP1MMP3
SCHEMBL4072144 0.77 MMP2 (0.47) MMP2MMP9MMP12MMP1MMP3
SCHEMBL4070632 0.76 MMP1 (0.43) MMP2MMP9MMP12MMP1MMP3
SCHEMBL4068694 0.76 MMP1 (0.45) MMP2MMP9MMP12MMP1MMP3

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 5 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

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 MMP2 2787/4885MMP9 3988/4885MMP12 4129/4885

“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.