SCHEMBL4334949

SCHEMBL4334949

COc1ccc(CC(OC(C)C)C(=O)O)cc1OCCOc1ccc(C2CCCC2)cc1

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PPARG P37231 14/20 0.50
PPARA Q07869 12/20 0.50
PPARD Q03181 5/20 0.50
MCHR1 Q99705 2/20 0.43
LDHA P00338 1/20 0.42
MMP1 P03956 2/20 0.42
PTGDR2 Q9Y5Y4 1/20 0.40

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
SCHEMBL4341706 0.99 PPARG (0.51) PPARGPPARAPPARDMCHR1LDHA
SCHEMBL4338050 0.84 PPARG (0.50) PPARGPPARAPPARD
SCHEMBL4346276 0.84 PPARA (0.55) PPARGPPARAPPARDLDHAMMP1
SCHEMBL4337259 0.83 PPARG (0.52) PPARGPPARAPPARD
SCHEMBL4341834 0.82 PPARA (0.53) PPARGPPARAPPARDLDHAMMP1
SCHEMBL5550663 0.82 PPARG (0.50) PPARGPPARAPPARD
SCHEMBL4334772 0.82 PPARA (0.59) PPARGPPARAPPARDLDHAMMP1
SCHEMBL5556259 0.81 PPARG (0.51) PPARGPPARAPPARD
SCHEMBL5380853 0.79 PPARG (0.59) PPARGPPARAPPARD
SCHEMBL14437953 0.79 PPARG (0.51) PPARGPPARAPPARD

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 5 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-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.