SCHEMBL1760558

SCHEMBL1760558

CCOC(=O)CN(Nc1c(COc2ccc(-c3cc(F)c(F)cc3C)cc2)cccc1C(=O)OC)C(=O)OC(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GYS1 P13807 17/20 0.41
SCN9A Q15858 1/20 0.34
RXRA P19793 1/20 0.34
NR1H2 P55055 1/20 0.34
NR1H3 Q13133 1/20 0.34
ALDH1A1 P00352 1/20 0.34
GAA P10253 1/20 0.34

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
SCHEMBL1760303 0.95 GYS1 (0.38) GYS1RXRANR1H2NR1H3ALDH1A1
SCHEMBL1760531 0.93 GYS1 (0.45) GYS1
SCHEMBL12635229 0.87 NR1H2 (0.39) RXRANR1H2NR1H3ALDH1A1
SCHEMBL1760492 0.86 GYS1 (0.44) GYS1SCN9ARXRANR1H2NR1H3
SCHEMBL1760550 0.82 GYS1 (0.38) GYS1RXRANR1H2NR1H3
SCHEMBL1876952 0.82 GYS1 (0.37) GYS1SCN9ARXRANR1H2NR1H3
SCHEMBL1876954 0.82 GYS1 (0.37) GYS1SCN9ARXRANR1H2NR1H3
SCHEMBL1881813 0.82 GYS1 (0.37) GYS1SCN9ARXRANR1H2NR1H3
SCHEMBL1760374 0.81 GYS1 (0.44) GYS1RXRANR1H2NR1H3
SCHEMBL1760323 0.80 PRKCZ (0.35) ALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011057993-A1 INDAZOLONE DERIVATIVES AS GLYCOGEN SYNTHASE ACTIVATORS F. HOFFMANN-LA ROCHE AG (CH) 2011-05-19 WO disclosed
US-20110112147-A1 INDAZOLONE ANALOGS AS GLYCOGEN SYNTHASE ACTIVATORS BOLIN DAVID ROBERT 2011-05-12 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-20110112147-A1 INDAZOLONE ANALOGS AS GLYCOGEN SYNTHASE ACTIVATORS GYS2, GYS1, PYGL GYS1 2/4885SCN9A 2201/4885RXRA 2824/4885

“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.