SCHEMBL4337003

SCHEMBL4337003

CC(C)OC(Cc1cccc(NC(=O)OCc2ccc(OC(F)(F)F)cc2)c1)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.48
PPARD Q03181 1/20 0.48
PPARA Q07869 1/20 0.48
MGLL Q99685 3/20 0.46
NLRP3 Q96P20 1/20 0.46
FPR2 P25090 1/20 0.45
ENPP2 Q13822 2/20 0.43
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
PDK1 Q15118 1/20 0.42
PDK2 Q15119 1/20 0.42
PDK3 Q15120 1/20 0.42
PDK4 Q16654 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
SCHEMBL4332279 0.93 MGLL (0.44) PPARGPPARDPPARAMGLLFPR2
SCHEMBL4335124 0.89 PPARG (0.54) PPARGPPARDPPARAFPR2
SCHEMBL4334192 0.89 MGLL (0.60) PPARGPPARDPPARAMGLLENPP2
SCHEMBL4343575 0.88 MGLL (0.49) PPARGPPARAMGLLENPP2
SCHEMBL4328671 0.87 PPARA (0.48) PPARGPPARDPPARAFPR2
SCHEMBL4331849 0.87 PPARA (0.48) PPARGPPARDPPARAFPR2
SCHEMBL4339204 0.87 MGLL (0.47) PPARGPPARDPPARAMGLLNLRP3
SCHEMBL4332402 0.85 MGLL (0.50) MGLLENPP2
SCHEMBL4341216 0.85 PPARG (0.45) PPARGPPARDPPARAMGLLNLRP3
SCHEMBL4340027 0.85 MGLL (0.53) PPARGPPARDPPARAMGLL

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 379/4885PPARD 753/4885PPARA 339/4885

“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.