SCHEMBL7995224

SCHEMBL7995224

Cc1cc(F)c(OC(C)(C)C(=O)O)c(F)c1

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 19/20 0.42
PPARG P37231 13/20 0.42
PPARD Q03181 13/20 0.42
MEN1 O00255 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
MAPT P10636 1/20 0.41
CYP2C19 P33261 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL1417573 0.87 PPARA (0.43) PPARAPPARGPPARDMEN1CYP1A2
SCHEMBL29306632 0.84 PPARA (0.51) PPARAPPARGPPARDMEN1CYP1A2
SCHEMBL14988854 0.81 PPARA (0.55) PPARAPPARGPPARDMEN1CYP1A2
SCHEMBL5472572 0.81 PPARA (0.40) PPARAPPARGPPARDMEN1CYP1A2
SCHEMBL1417528 0.80 PPARA (0.49) PPARAPPARGCYP1A2CYP3A4
SCHEMBL12670978 0.80 CNR1 (0.33) MEN1KMT2A
SCHEMBL7994922 0.79 KDM4E (0.49) PPARAPPARGPPARDMEN1CYP1A2
SCHEMBL31426784 0.78 ALDH1A1 (0.45) PPARAPPARGPPARDMEN1CYP1A2
SCHEMBL12329622 0.75 PPARA (0.46) PPARAPPARGPPARDMEN1CYP1A2
SCHEMBL659617 0.75 PPARA (0.53) PPARAPPARGPPARDMEN1CYP1A2

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
US-8377923-B2 Triazole derivative or salt thereof ASTELLAS PHARMA INC. (JP) 2013-02-19 US disclosed
US-20110105460-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF ASTELLAS PHARMA INC. (JP) 2011-05-05 US disclosed
EP-2298747-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF Astellas Pharma Inc. (JP) 2011-03-23 EP disclosed
WO-2010001946-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF アステラス製薬株式会社 (JP) 2010-01-07 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-20110105460-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF HSD11B1, HSD11B2, HSD3B1 PPARA 455/4885PPARG 396/4885PPARD 241/4885

“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.