SCHEMBL6427465

SCHEMBL6427465

COc1ccc(CC2(C(=O)O)CCCO2)cc1CNC(=O)c1sc(-c2ccc(Cl)cc2Cl)nc1C

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 7/20 0.39
PPARD Q03181 2/20 0.39
PPARG P37231 5/20 0.38
TDP1 Q9NUW8 1/20 0.37
MAPT P10636 4/20 0.37
KDM4E B2RXH2 3/20 0.37
EGFR P00533 1/20 0.36
KDR P35968 1/20 0.36
TSHR P16473 1/20 0.36
RECQL P46063 1/20 0.36
TP53 P04637 1/20 0.36
RXFP1 Q9HBX9 1/20 0.35
CTSA P10619 1/20 0.35
HTT P42858 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
ALDH1A1 P00352 1/20 0.34
HPGD P15428 1/20 0.34
HSD17B10 Q99714 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
SCHEMBL5034527 0.91 PPARA (0.47) PPARAPPARDPPARGMAPTKDM4E
SCHEMBL5034523 0.88 HPGD (0.46) PPARAPPARGMAPTNPSR1ALDH1A1
SCHEMBL5031926 0.87 PPARA (0.44) PPARAPPARDPPARGMAPTKDM4E
SCHEMBL5034446 0.87 SCD (0.41) PPARAPPARDPPARGMAPTKDM4E
SCHEMBL5037057 0.84 PPARA (0.39) PPARAPPARDPPARGTDP1MAPT
SCHEMBL5034516 0.84 PPARA (0.46) PPARAPPARDPPARGMAPTKDM4E
SCHEMBL6428294 0.83 CYP1A2 (0.45) PPARAPPARGMAPTALDH1A1HPGD
SCHEMBL5034531 0.83 PPARA (0.41) PPARAPPARDPPARGMAPTKDR
SCHEMBL5032944 0.79 PPARA (0.56) PPARAPPARDPPARGKDM4E
SCHEMBL5032777 0.78 ANO1 (0.49) PPARAPPARGKDM4ETP53ALDH1A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050014833-A1 Cyclic compound and ppar agonist EISAI R&D MANAGEMENT CO., LTD. (JP) 2005-01-20 US disclosed
EP-1452521-A1 CYCLIC COMPOUND AND PPAR AGONIST Eisai Co., Ltd. (JP) 2004-09-01 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-20050014833-A1 Cyclic compound and ppar agonist PPARA, PPARG, PPARD PPARA 1/4885PPARD 3/4885PPARG 2/4885

“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.