SCHEMBL3416004

SCHEMBL3416004

CCOC(=O)C(CC)Cc1cccc(-c2ccc(OC)c(CNC(=O)OC(C)(C)C)c2)c1

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 15/20 0.51
PPARD Q03181 11/20 0.51
PPARG P37231 11/20 0.51
EPHX2 P34913 3/20 0.47
ITGA4 P13612 1/20 0.43
ITGB7 P26010 1/20 0.43
CTSB P07858 1/20 0.42
CTSS P25774 1/20 0.42
CTSK P43235 1/20 0.42

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
SCHEMBL13433354 0.83 SYK (0.45) PPARAPPARDPPARGEPHX2ITGA4
SCHEMBL3418629 0.82 PPARA (0.45) PPARAPPARDPPARGITGA4ITGB7
SCHEMBL3416367 0.81 PPARG (0.44) PPARAPPARDPPARGITGA4ITGB7
SCHEMBL13433343 0.77 FDPS (0.47) PPARAPPARDPPARG
SCHEMBL3419255 0.77 TRPV1 (0.48) PPARAPPARDPPARGITGA4ITGB7
SCHEMBL3415307 0.76 PPARD (0.63) PPARAPPARDPPARGEPHX2
SCHEMBL3416346 0.76 PPARG (0.53) PPARAPPARDPPARG
SCHEMBL13433348 0.76 EPHX2 (0.48) PPARAPPARDPPARGEPHX2ITGA4
SCHEMBL3413605 0.76 PPARG (0.45) PPARAPPARDPPARGITGA4ITGB7
SCHEMBL6496923 0.76 PPARA (0.45) PPARAPPARDPPARG

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-7687664-B2 Carboxylic acid derivative, a salt thereof or an ester of them, and medicament comprising it EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-03-30 US disclosed
US-7687664-B2 Carboxylic acid derivative, a salt thereof or an ester of them, and medicament comprising it EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-03-30 US disclosed
US-20040214888-A1 Carboxylic acid derivative and medicine comprising salt or ester of the same EISAI R&D MANAGEMENT CO., LTD. (JP) 2004-10-28 US disclosed
EP-1394147-A1 CARBOXYLIC ACID DERIVATIVE AND MEDICINE COMPRISING SALT OR ESTER OF THE SAME Eisai Co., Ltd. (JP) 2004-03-03 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-20040214888-A1 Carboxylic acid derivative and medicine comprising salt or ester of the same GPR119, NR3C1, INSR PPARA 130/4885PPARD 689/4885PPARG 238/4885

“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.