SCHEMBL4332636

SCHEMBL4332636

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

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 14/20 0.45
PPARG P37231 14/20 0.45
PTGES O14684 4/20 0.44
PPARD Q03181 6/20 0.44
MMP1 P03956 1/20 0.39
AKR1C3 P42330 1/20 0.39

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
SCHEMBL4338932 0.91 PPARA (0.45) PPARAPPARGPTGESPPARD
SCHEMBL4332660 0.91 PPARA (0.47) PPARAPPARGPTGESPPARD
SCHEMBL13810053 0.90 PPARG (0.41) PPARAPPARGPTGESPPARD
SCHEMBL4335099 0.85 PTGES (0.54) PPARAPPARGPTGESPPARD
SCHEMBL4335668 0.85 PPARG (0.42) PPARAPPARGPTGESPPARD
SCHEMBL4334220 0.84 PPARG (0.41) PPARAPPARGPTGESPPARD
SCHEMBL13810060 0.83 PPARA (0.45) PPARAPPARGPTGESPPARDMMP1
SCHEMBL13810005 0.83 PPARA (0.49) PPARAPPARGPTGESPPARD
SCHEMBL13819487 0.81 PPARG (0.51) PPARAPPARGPPARDMMP1
SCHEMBL4337056 0.80 PPARA (0.42) PPARAPPARGPPARD

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 PPARA 339/4885PPARG 379/4885PTGES 3685/4885

“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.