SCHEMBL8255498

SCHEMBL8255498

O=S(=O)(N[C@H]1CC[C@@](c2cc(F)ccc2F)(S(=O)(=O)c2ccccc2)CC1)C(F)(F)F

nearest known ligand 0.82

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 20/20 0.82
PSEN2 P49810 20/20 0.82
APH1B Q8WW43 20/20 0.82
NCSTN Q92542 20/20 0.82
APH1A Q96BI3 20/20 0.82
PSENEN Q9NZ42 20/20 0.82
APP P05067 1/20 0.82
CYP3A4 P08684 1/20 0.82
SLC6A3 Q01959 1/20 0.82
SLC18A2 Q05940 1/20 0.82

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
Mrk-560 SCHEMBL237759 0.90 PSEN1 (1.00) PSEN1PSEN2APH1BNCSTNAPH1A
Mrk-560 SCHEMBL29358202 0.90 PSEN1 (1.00) PSEN1PSEN2APH1BNCSTNAPH1A
Mrk-560 SCHEMBL237758 0.90 PSEN1 (1.00) PSEN1PSEN2APH1BNCSTNAPH1A
Mrk-560 SCHEMBL237760 0.90 PSEN1 (1.00) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8257641 0.89 PSEN1 (0.83) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8255255 0.88 PSEN1 (0.80) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8339487 0.88 PSEN1 (0.80) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8255159 0.88 PSEN1 (0.80) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8246606 0.87 PSEN1 (0.78) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8342639 0.87 PSEN1 (0.78) PSEN1PSEN2APH1BNCSTNAPH1A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1551799-B1 CYCLOHEXYL SULPHONES AS GAMMA-SECRETASE INHIBITORS MERCK SHARP & DOHME (GB) 2010-04-14 EP disclosed
US-20090215775-A1 Sulphonamido-Substituted Cyclohexyl Sulphones for Treatment of Cancer MERCK SHARP & DOHME LTD. (GB) 2009-08-27 US disclosed
US-20090215775-A1 Sulphonamido-Substituted Cyclohexyl Sulphones for Treatment of Cancer MERCK SHARP & DOHME LTD. (GB) 2009-08-27 US disclosed
WO-2006123184-A2 SULPHONAMIDO-SUBSTITUTED CYCLOHEXYL SULPHONES FOR TREATMENT OF CANCER MERCK SHARP & DOHME LIMITED (GB) 2006-11-23 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-20090215775-A1 Sulphonamido-Substituted Cyclohexyl Sulphones for Treatment of Cancer SDHA, SDHB, TP53 PSEN1 2352/4885PSEN2 2663/4885APH1B 2036/4885

“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.