SCHEMBL2806952

SCHEMBL2806952

CCOC(=O)c1c(Cc2cccc(C(F)(F)F)c2)c2ccccc2n1Cc1cc(OS(C)(=O)=O)cc(OS(C)(=O)=O)c1

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PPARG P37231 11/20 0.48
MAPT P10636 2/20 0.43
MAPK10 P53779 1/20 0.43
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
HDAC1 Q13547 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
F10 P00742 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
SCHEMBL2805778 0.95 PPARG (0.46) PPARGMAPTMAPK10MEN1KMT2A
SCHEMBL2809099 0.92 PPARG (0.42) PPARGMAPTMAPK10MEN1KMT2A
SCHEMBL2809209 0.81 EDNRB (0.40) PPARGMAPTMAPK10MEN1KMT2A
SCHEMBL6851282 0.78 ALDH1A1 (0.48) PPARGMAPTMAPK10MEN1KMT2A
SCHEMBL6851392 0.77 MEN1 (0.63) PPARGMAPTMAPK10MEN1KMT2A
SCHEMBL2809106 0.76 PPARG (0.45) PPARGMAPTMEN1KMT2A
SCHEMBL6856138 0.76 MAPT (0.51) PPARGMAPTMAPK10MEN1KMT2A
SCHEMBL2809029 0.76 PPARG (0.50) PPARGMAPTMAPK10MEN1KMT2A
SCHEMBL6857667 0.74 MEN1 (0.49) PPARGMAPTMAPK10MEN1KMT2A
SCHEMBL6857727 0.74 PPARG (0.72) PPARGMAPTMAPK10KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100240642-A1 1H-Indole-2-Carboxylic Acid Derivatives Useful As PPAR Modulators SMITHKLINE BEECHAM CORPORATION (US) 2010-09-23 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-20100240642-A1 1H-Indole-2-Carboxylic Acid Derivatives Useful As PPAR Modulators PPARD, PPARA, PPARG PPARG 3/4885MAPT 2916/4885MAPK10 2365/4885

“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.