SCHEMBL5511937

SCHEMBL5511937

Cc1cc(SCc2nc(-c3ccc(-c4cc(C(F)(F)F)cc(C(F)(F)F)c4)cc3)oc2C)ccc1OCC(=O)O

nearest known ligand 0.68

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 17/20 0.68
PPARA Q07869 8/20 0.68
PPARG P37231 4/20 0.68
PTPN1 P18031 2/20 0.50
MAPT P10636 2/20 0.50
TP53 P04637 1/20 0.50
MEN1 O00255 1/20 0.49
ALDH1A1 P00352 1/20 0.49
CYP3A4 P08684 1/20 0.49
HPGD P15428 1/20 0.49
ALOX15 P16050 1/20 0.49
KMT2A Q03164 1/20 0.49
HSD17B10 Q99714 1/20 0.49

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
SCHEMBL14434651 0.88 PPARD (0.61) PPARDPPARAPPARGMAPTTP53
SCHEMBL5112628 0.83 PPARD (0.61) PPARDPPARAPPARGPTPN1MAPT
SCHEMBL4680724 0.82 PPARD (0.82) PPARDPPARAPPARG
SCHEMBL5518617 0.82 PPARD (0.54) PPARDPPARAPPARGMAPTTP53
SCHEMBL3819065 0.81 PPARD (1.00) PPARDPPARAPPARG
SCHEMBL5517514 0.79 PPARD (0.88) PPARDPPARAPPARGMAPTMEN1
SCHEMBL3919912 0.78 PPARD (0.71) PPARDPPARAPPARG
SCHEMBL3920736 0.78 PPARD (0.71) PPARDPPARAPPARG
SCHEMBL5218966 0.78 PPARD (0.71) PPARDPPARAPPARG
SCHEMBL13292326 0.77 PPARD (1.00) PPARDPPARAPPARG

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-7259175-B2 Peroxisome proliferator activated receptor modulators ELI LILLY AND COMPANY (US) 2007-08-21 US disclosed
US-7259175-B2 Peroxisome proliferator activated receptor modulators ELI LILLY AND COMPANY (US) 2007-08-21 US disclosed
US-7259175-B2 Peroxisome proliferator activated receptor modulators ELI LILLY AND COMPANY (US) 2007-08-21 US disclosed
US-20060084663-A1 Peroxisome proliferator activated receptor modulators ELI LILLY AND COMPANY, PATENT DIVISION (US) 2006-04-20 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-20060084663-A1 Peroxisome proliferator activated receptor modulators PPARG, PPARA, PPARD PPARD 3/4885PPARA 2/4885PPARG 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.