SCHEMBL5850832

SCHEMBL5850832

CC(C)c1nc(-c2ccc(C(F)(F)F)cc2)oc1C(C)CSc1cccc(CC(=O)O)c1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PPARG P37231 8/20 0.42
PPARA Q07869 7/20 0.42
PPARD Q03181 9/20 0.41
PSEN1 P49768 1/20 0.39
PSEN2 P49810 1/20 0.39
APH1B Q8WW43 1/20 0.39
NCSTN Q92542 1/20 0.39
APH1A Q96BI3 1/20 0.39
PSENEN Q9NZ42 1/20 0.39
TP53 P04637 1/20 0.39
MAPT P10636 1/20 0.39
PTPN1 P18031 5/20 0.39
CYP2C9 P11712 1/20 0.38
KCNH2 Q12809 1/20 0.38

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
SCHEMBL6613591 0.90 PPARD (0.47) PPARGPPARAPPARDPSEN1PSEN2
SCHEMBL5850863 0.89 TP53 (0.45) PPARGPPARAPPARDPSEN1PSEN2
SCHEMBL4675683 0.86 PPARD (0.51) PPARGPPARAPPARDPSEN1PSEN2
SCHEMBL4676542 0.84 PPARG (0.44) PPARGPPARAPPARDPSEN1PSEN2
SCHEMBL5852561 0.82 PPARA (0.46) PPARGPPARAPPARDPTPN1CYP2C9
SCHEMBL5850533 0.81 PPARD (0.44) PPARGPPARAPPARD
SCHEMBL6617799 0.81 PPARA (0.44) PPARGPPARAPPARDTP53MAPT
SCHEMBL5850797 0.79 PPARD (0.45) PPARGPPARAPPARDPSEN1PSEN2
SCHEMBL5852182 0.78 PPARD (0.44) PPARGPPARAPPARDPSEN1PSEN2
SCHEMBL4679101 0.77 PPARD (0.53) PPARGPPARAPPARDPTPN1CYP2C9

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-7153878-B2 Peroxisome proliferator activated receptor modulators ELI LILLY AND COMPANY (US) 2006-12-26 US disclosed
US-20050107449-A1 Peroxisome proliferator activated receptor modulators ELILILLY AND COMPANY 2005-05-19 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-20050107449-A1 Peroxisome proliferator activated receptor modulators PPARG, PPARA, PPARD PPARG 1/4885PPARA 2/4885PPARD 3/4885

“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.