SCHEMBL13899240

SCHEMBL13899240

CC(C)(Oc1ccc(OC(c2ccccc2)c2nnc(-c3ccc(C(F)(F)F)cc3)o2)cc1)C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 13/20 0.45
PPARG P37231 8/20 0.45
PPARD Q03181 8/20 0.45
ABCG2 Q9UNQ0 1/20 0.42
PTPN1 P18031 2/20 0.42
KDM4E B2RXH2 3/20 0.40
NPC1 O15118 1/20 0.40
HPGD P15428 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
ALDH1A1 P00352 2/20 0.39
POLB P06746 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C19 P33261 1/20 0.39
HSD17B10 Q99714 1/20 0.39
MEN1 O00255 1/20 0.39
TSHR P16473 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL13899214 0.88 PPARA (0.48) PPARAPPARGPPARDHPGD
SCHEMBL13899432 0.84 PPARA (0.46) PPARAPPARGPPARDPTPN1
SCHEMBL13899434 0.80 PPARA (0.45) PPARAPPARGPPARDPTPN1
SCHEMBL13899433 0.78 PPARA (0.44) PPARAPPARGPPARD
SCHEMBL13899364 0.76 PPARD (0.51) PPARAPPARGPPARD
SCHEMBL13899447 0.75 PPARA (0.43) PPARAPPARGPPARD
SCHEMBL13899480 0.74 PPARD (0.50) PPARAPPARGPPARD
SCHEMBL13899451 0.74 PPARA (0.46) PPARAPPARGPPARD
SCHEMBL13899379 0.73 PPARD (0.51) PPARAPPARGPPARD
SCHEMBL13899473 0.73 PPARA (0.54) PPARAPPARGPPARDNPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7507832-B2 Triazole PPAR modulators ELI LILLY AND COMPANY (US) 2009-03-24 US disclosed
US-7507832-B2 Triazole PPAR modulators ELI LILLY AND COMPANY (US) 2009-03-24 US disclosed
US-20070112045-A1 Triazole ppar modulators ELI LILLY AND COMPANY 2007-05-17 US disclosed
US-20070112045-A1 Triazole ppar modulators ELI LILLY AND COMPANY 2007-05-17 US 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-20070112045-A1 Triazole ppar modulators PPARD, PPARA, PPARG PPARA 2/4885PPARG 3/4885PPARD 1/4885

“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.