SCHEMBL4334220

SCHEMBL4334220

CC(C)OC(Cc1cccc(C#CC(C)(O)c2ccc(C3CCCCC3)cc2)c1)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPARG P37231 9/20 0.41
PPARA Q07869 9/20 0.41
PPARD Q03181 4/20 0.37
KIF11 P52732 1/20 0.36
F10 P00742 2/20 0.36
ACE P12821 2/20 0.35
CYP3A4 P08684 1/20 0.34
CYP2C9 P11712 1/20 0.34
GCGR P47871 1/20 0.34
GIPR P48546 1/20 0.34
PTGES O14684 2/20 0.33
APP P05067 1/20 0.32
MRGPRX4 Q96LA9 1/20 0.32
F2 P00734 1/20 0.32
PLG P00747 1/20 0.32
PLAU P00749 1/20 0.32
ST14 Q9Y5Y6 1/20 0.32

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
SCHEMBL4332636 0.84 PPARA (0.45) PPARGPPARAPPARDPTGES
SCHEMBL13810053 0.84 PPARG (0.41) PPARGPPARAPPARDPTGES
SCHEMBL13819765 0.83 PPARG (0.42) PPARGPPARAPPARDKIF11F10
SCHEMBL4335668 0.80 PPARG (0.42) PPARGPPARAPPARDPTGES
SCHEMBL4332660 0.78 PPARA (0.47) PPARGPPARAPPARDCYP3A4CYP2C9
SCHEMBL4337259 0.77 PPARG (0.52) PPARGPPARAPPARDMRGPRX4
SCHEMBL4338932 0.76 PPARA (0.45) PPARGPPARAPPARDCYP3A4CYP2C9
SCHEMBL4338050 0.76 PPARG (0.50) PPARGPPARAPPARDMRGPRX4
SCHEMBL4337056 0.75 PPARA (0.42) PPARGPPARAPPARD
SCHEMBL4329800 0.75 PPARA (0.42) PPARGPPARAPPARDPTGES

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-7544835-B2 Carboxylic acid derivative and salt thereof EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-06-09 US disclosed
US-7544835-B2 Carboxylic acid derivative and salt thereof EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-06-09 US disclosed
US-20040102634-A1 Carboxylic acid derivative and salt thereof EISAI R&D MANAGEMENT CO., LTD. (JP) 2004-05-27 US disclosed
EP-1380562-A1 CARBOXYLIC ACID DERIVATIVE AND SALT THEREOF Eisai Co., Ltd. (JP) 2004-01-14 EP 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-20040102634-A1 Carboxylic acid derivative and salt thereof GPR119, IRS1, SLC5A1 PPARG 379/4885PPARA 339/4885PPARD 753/4885

“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.