SCHEMBL4334110

SCHEMBL4334110

CC(C)OC(Cc1cccc(OCC(O)COc2ccc(Br)cc2)c1)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARG P37231 16/20 0.49
PPARA Q07869 16/20 0.49
PPARD Q03181 12/20 0.49
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
MAPT P10636 1/20 0.42
MRGPRX4 Q96LA9 1/20 0.41

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
SCHEMBL4334218 1.00 PPARG (0.49) PPARGPPARAPPARDKDM4EMEN1
SCHEMBL4334214 1.00 PPARG (0.49) PPARGPPARAPPARDKDM4EMEN1
SCHEMBL4334564 0.90 PPARG (0.48) PPARGPPARAPPARDMEN1KMT2A
SCHEMBL4334574 0.90 PPARG (0.48) PPARGPPARAPPARDMEN1KMT2A
SCHEMBL4334569 0.90 PPARG (0.48) PPARGPPARAPPARDMEN1KMT2A
SCHEMBL4337132 0.89 PPARG (0.49) PPARGPPARAPPARD
SCHEMBL4336268 0.89 PPARA (0.50) PPARGPPARAPPARD
SCHEMBL4327605 0.89 PPARG (0.55) PPARGPPARAPPARDMEN1KMT2A
SCHEMBL4336261 0.89 PPARA (0.50) PPARGPPARAPPARD
SCHEMBL4327608 0.89 PPARG (0.55) PPARGPPARAPPARDMEN1KMT2A

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.