SCHEMBL2796376

SCHEMBL2796376

O=C(NCO)c1cc(C(c2c(F)ccc(F)c2F)S(=O)(=O)CCC(F)(F)F)c(Cl)cn1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LIPC P11150 9/20 0.34
LIPG Q9Y5X9 9/20 0.34
BRAF P15056 1/20 0.33
GRIN1 Q05586 1/20 0.32
GRIN2A Q12879 1/20 0.32
CNR2 P34972 1/20 0.32
EGLN1 Q9GZT9 1/20 0.31

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
SCHEMBL2798695 0.88 LIPC (0.37) LIPCLIPGBRAF
SCHEMBL2795900 0.87 TGFBR1 (0.34) LIPCLIPGBRAFCNR2
SCHEMBL13262434 0.85 LIPC (0.33) LIPCLIPGBRAF
SCHEMBL13262604 0.83 LOXL2 (0.39) LIPCLIPGBRAF
SCHEMBL2798256 0.83 MMP13 (0.33) LIPCGRIN1GRIN2AEGLN1
SCHEMBL2795451 0.82 LIPG (0.30) LIPCLIPG
SCHEMBL2798119 0.82 MMP13 (0.34) LIPCLIPGGRIN1GRIN2A
SCHEMBL2797457 0.82 METAP2 (0.38) LIPCLIPGBRAF
SCHEMBL2799420 0.81 MMP13 (0.33) LIPC
SCHEMBL2794635 0.81 PIK3CD (0.32) LIPCLIPG

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
EP-2204365-A1 ALKYLSULFONE DERIVATIVE Daiichi Sankyo Company, Limited (JP) 2010-07-07 EP disclosed
US-20100168136-A1 ALKYLSULFONE DERIVATIVES DAIICHI SANKYO COMPANY, LIMITED (JP) 2010-07-01 US disclosed
US-20100168136-A1 ALKYLSULFONE DERIVATIVES DAIICHI SANKYO COMPANY, LIMITED (JP) 2010-07-01 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-20100168136-A1 ALKYLSULFONE DERIVATIVES BACE1, APP, AMY1A LIPC 1380/4885LIPG 3653/4885BRAF 1162/4885

“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.