SCHEMBL4336600

SCHEMBL4336600

CCOc1ccc(CC(OC(C)C)C(=O)O)cc1NC(=O)OCc1cccc(C)n1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PPARG P37231 10/20 0.41
PPARA Q07869 10/20 0.41
PPARD Q03181 9/20 0.41
PTGDR2 Q9Y5Y4 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.36
TP53 P04637 2/20 0.35
MAPT P10636 1/20 0.35
PDE5A O76074 1/20 0.34
RECQL P46063 1/20 0.34

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
SCHEMBL13810649 0.92 PPARG (0.39) PPARGPPARAPPARDPTGDR2SMN1; SMN2
SCHEMBL4332216 0.86 CYSLTR1 (0.43) PPARGPPARAPPARD
SCHEMBL4347121 0.85 RECQL (0.38) PPARGPPARAPPARDRECQL
SCHEMBL4336608 0.82 PPARG (0.42) PPARGPPARAPPARDSMN1; SMN2MAPT
SCHEMBL4334577 0.81 SCN9A (0.40) PPARGPPARAPPARD
SCHEMBL4327205 0.81 ATM (0.42) PPARGPPARAPPARDSMN1; SMN2TP53
SCHEMBL4347011 0.80 SMN1; SMN2 (0.39) PPARGPPARAPTGDR2SMN1; SMN2
SCHEMBL4346189 0.80 CYP1A2 (0.47) PPARGPPARAPPARD
SCHEMBL4329917 0.80 DNMT1 (0.40) PPARGPPARAPPARDSMN1; SMN2TP53
SCHEMBL4333264 0.79 RXFP1 (0.38) PPARGPPARAPPARDSMN1; SMN2

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.