SCHEMBL4769666

SCHEMBL4769666

CS(=O)(=O)Nc1ccc(-c2ccc(C(F)(F)F)cc2N)cc1

nearest known ligand 0.66

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 12/20 0.66
SLC22A12 Q96S37 1/20 0.47
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
PTGS2 P35354 1/20 0.46
ALOX5AP P20292 1/20 0.44
FEN1 P39748 1/20 0.44
NR3C2 P08235 1/20 0.43
IKBKB O14920 1/20 0.43
CHUK O15111 1/20 0.43

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
SCHEMBL3375797 0.92 KIF11 (0.66) KIF11SLC22A12CA1CA2PTGS2
SCHEMBL4662560 0.84 KIF11 (0.68) KIF11SLC22A12ALOX5APFEN1
SCHEMBL4661074 0.83 KIF11 (0.66) KIF11SLC22A12CA1CA2PTGS2
SCHEMBL4661255 0.82 KIF11 (0.58) KIF11CA1CA2PTGS2IKBKB
SCHEMBL3380022 0.80 KIF11 (1.00) KIF11SLC22A12CA1CA2NR3C2
SCHEMBL3378328 0.79 KIF11 (0.75) KIF11SLC22A12ALOX5APFEN1
SCHEMBL4662605 0.79 KIF11 (0.68) KIF11SLC22A12
SCHEMBL3378781 0.79 KIF11 (0.68) KIF11SLC22A12
SCHEMBL13656086 0.78 KIF11 (0.89) KIF11CA1CA2NR3C2
SCHEMBL3375971 0.78 KIF11 (0.66) KIF11SLC22A12

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-1694281-A4 BIPHENYL COMPOUNDS AND METHODS SMITHKLINE BEECHAM CORP (US) 2008-12-24 EP disclosed
US-20070259951-A1 Compounds, Compositions and Methods SMITHKLINE BEECHAM CORPORATION (US) 2007-11-08 US disclosed
EP-1694281-A2 BIPHENYL COMPOUNDS AND METHODS SMITHKLINE BEECHAM CORPORATION (US) 2006-08-30 EP disclosed
WO-2005060692-A2 BIPHENYL COMPOUNDS AND METHODS SMITHKLINE BEECHAM CORPORATION (US) 2005-07-07 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-20070259951-A1 Compounds, Compositions and Methods ALPP, PCNA, MKI67 KIF11 824/4885SLC22A12 3290/4885CA1 2205/4885

“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.