SCHEMBL3413798

SCHEMBL3413798

COc1ccc(-c2cccc(C(=O)O)c2)c(CNC(=O)c2ccc(Cl)cc2Cl)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.49
TP53 P04637 1/20 0.49
PPARG P37231 2/20 0.47
PPARA Q07869 2/20 0.47
PPARD Q03181 1/20 0.47
TAS1R3 Q7RTX0 1/20 0.47
TAS1R1 Q7RTX1 1/20 0.47
DGAT2 Q96PD7 2/20 0.46
GCGR P47871 1/20 0.46
FLT1 P17948 2/20 0.45
FLT4 P35916 2/20 0.45
KDR P35968 2/20 0.45
PTGDR Q13258 1/20 0.44
EPHX2 P34913 1/20 0.44
ALDH1A1 P00352 1/20 0.43
GAA P10253 1/20 0.43
PKM P14618 1/20 0.43
HPGD P15428 1/20 0.43
HTT P42858 1/20 0.43
PYGL P06737 1/20 0.43

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
SCHEMBL3418799 0.94 PPARA (0.49) MAPTTP53PPARGPPARAPPARD
SCHEMBL3413568 0.88 PTPN11 (0.51) MAPTTP53PPARGPPARAPPARD
SCHEMBL3413959 0.87 SHMT1 (0.49) MAPTTP53TAS1R3TAS1R1DGAT2
SCHEMBL3414230 0.82 PPARA (0.63) MAPTTP53PPARGPPARAPPARD
SCHEMBL3418778 0.81 HSD17B10 (0.52) MAPTTP53TAS1R3TAS1R1GCGR
SCHEMBL3416135 0.80 PPARD (0.64) PPARGPPARAPPARDEPHX2
SCHEMBL3414951 0.79 PPARA (0.58) MAPTPPARGPPARAPPARDFLT1
SCHEMBL3415421 0.79 ACLY (0.45) MAPTTP53PPARAPPARDTAS1R3
SCHEMBL3419117 0.79 PPARA (0.54) MAPTTP53PPARGPPARAPPARD
SCHEMBL3414382 0.78 ACLY (0.55) PPARGPPARAPPARDFLT1FLT4

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-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-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 MAPT 4765/4885TP53 4404/4885PPARG 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.