SCHEMBL4335668

SCHEMBL4335668

CC(C)OC(Cc1cccc(C#CC(C)(O)c2cccc(-c3ccccc3)c2)c1)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PPARG P37231 17/20 0.42
PPARA Q07869 16/20 0.42
PPARD Q03181 6/20 0.42
PTGES O14684 1/20 0.40
SRR Q9GZT4 2/20 0.38
PSAT1 Q9Y617 2/20 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
SCHEMBL13810053 0.93 PPARG (0.41) PPARGPPARAPPARDPTGESSRR
SCHEMBL4332660 0.86 PPARA (0.47) PPARGPPARAPPARDPTGES
SCHEMBL4332636 0.85 PPARA (0.45) PPARGPPARAPPARDPTGES
SCHEMBL4337056 0.83 PPARA (0.42) PPARGPPARAPPARD
SCHEMBL4329800 0.83 PPARA (0.42) PPARGPPARAPPARDPTGES
SCHEMBL4338932 0.82 PPARA (0.45) PPARGPPARAPPARDPTGES
SCHEMBL4334220 0.80 PPARG (0.41) PPARGPPARAPPARDPTGES
SCHEMBL4483847 0.79 PPARA (0.42) PPARGPPARAPPARDPTGES
SCHEMBL6652604 0.79 PPARG (0.43) PPARGPPARAPPARD
SCHEMBL4335099 0.78 PTGES (0.54) 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 3 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-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.