SCHEMBL4338949

SCHEMBL4338949

COc1ccc(NC(=O)OCc2ccc(C(F)(F)F)cc2)cc1CC(OC(C)C)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 13/20 0.49
PPARD Q03181 8/20 0.47
MGLL Q99685 1/20 0.47
MAPT P10636 1/20 0.46
PPARG P37231 4/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
PTGDR2 Q9Y5Y4 1/20 0.43
MMP1 P03956 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
L3MBTL1 Q9Y468 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
SCHEMBL4337108 0.89 PPARA (0.45) PPARAPPARDMAPTPPARGSMN1; SMN2
SCHEMBL4328750 0.89 PPARA (0.56) PPARAPPARDPPARGMMP1
SCHEMBL4329694 0.89 MGLL (0.48) PPARAPPARDMGLLMAPTPPARG
SCHEMBL4335887 0.89 SMN1; SMN2 (0.44) PPARAMGLLMAPTSMN1; SMN2PTGDR2
SCHEMBL4328897 0.89 PPARA (0.43) PPARAPPARDMGLLMAPTPPARG
SCHEMBL4342350 0.88 PPARA (0.44) PPARAPPARDMAPTPPARGSMN1; SMN2
SCHEMBL4341713 0.88 PPARA (0.44) PPARAPPARDMAPTPPARGSMN1; SMN2
SCHEMBL13810706 0.87 SMN1; SMN2 (0.43) MGLLMAPTSMN1; SMN2MEN1KMT2A
SCHEMBL4343465 0.86 SMN1; SMN2 (0.45) MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL4347142 0.85 MEN1 (0.52) PPARAPPARDMGLLPPARGSMN1; 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 PPARA 339/4885PPARD 753/4885MGLL 3539/4885

“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.