SCHEMBL6634036

SCHEMBL6634036

Cc1cc(SCc2sc(-c3ccc(C(F)(F)F)cc3)nc2C)c2c(c1OCC(=O)O)CCCO2

nearest known ligand 0.68

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 19/20 0.68
PPARA Q07869 13/20 0.68
PPARG P37231 11/20 0.68
FFAR1 O14842 4/20 0.51
MEN1 O00255 1/20 0.48
ALDH1A1 P00352 1/20 0.48
CYP3A4 P08684 1/20 0.48
MAPT P10636 1/20 0.48
HPGD P15428 1/20 0.48
ALOX15 P16050 1/20 0.48
KMT2A Q03164 1/20 0.48
HSD17B10 Q99714 1/20 0.48

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
SCHEMBL6619400 0.97 PPARD (0.64) PPARDPPARAPPARGFFAR1MEN1
SCHEMBL6860510 0.92 PPARD (0.58) PPARDPPARAPPARGFFAR1MEN1
SCHEMBL6625015 0.90 PPARD (0.65) PPARDPPARAPPARGFFAR1MEN1
SCHEMBL6632768 0.89 PPARD (0.54) PPARDPPARAPPARGFFAR1MEN1
SCHEMBL6621552 0.88 PPARD (0.66) PPARDPPARAPPARGFFAR1MEN1
SCHEMBL5511576 0.83 PPARD (0.75) PPARDPPARAPPARG
SCHEMBL6624010 0.82 PPARD (0.55) PPARDPPARAPPARGFFAR1MEN1
SCHEMBL4673921 0.82 PPARD (0.81) PPARDPPARAPPARGFFAR1MEN1
SCHEMBL5507328 0.81 PPARD (1.00) PPARDPPARAPPARG
SCHEMBL6617715 0.81 PPARD (0.56) PPARDPPARAPPARGFFAR1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6833380-B2 Thiazole or oxazole derivatives such as (4-(4-Methyl-2-(4-trifluoromethyl-phenyl)-thiazol-5-ylmethylsulfanyl)-5-oxo -5,6,7,8-tetrahydro-naphthalen-1-yloxy)-acetic acid WARNER-LAMBERT COMPANY, LLC 2004-12-21 US claimed
EP-1485091-A1 THIAZOLE AND OXAZOLE DERIVATIVES THAT MODULATE PPAR ACTIVITY Warner-Lambert Company LLC (US) 2004-12-15 EP claimed
US-20030207916-A1 Thiazole or oxazole derivatives such as (4-(4-Methyl-2-(4-trifluoromethyl-phenyl)-thiazol-5-ylmethylsulfanyl)-5-oxo -5,6,7,8-tetrahydro-naphthalen-1-yloxy)-acetic acid CHENG XUE-MIN (US) 2003-11-06 US claimed
WO-2003074052-A1 THIAZOLE AND OXAZOLE DERIVATIVES THAT MODULATE PPAR ACTIVITY WARNER-LAMBERT COMPANY LLC (US) 2003-09-12 WO claimed
US-6833380-B2 Thiazole or oxazole derivatives such as (4-(4-Methyl-2-(4-trifluoromethyl-phenyl)-thiazol-5-ylmethylsulfanyl)-5-oxo -5,6,7,8-tetrahydro-naphthalen-1-yloxy)-acetic acid WARNER-LAMBERT COMPANY, LLC 2004-12-21 US disclosed
EP-1485091-A1 THIAZOLE AND OXAZOLE DERIVATIVES THAT MODULATE PPAR ACTIVITY Warner-Lambert Company LLC (US) 2004-12-15 EP disclosed
US-20030207916-A1 Thiazole or oxazole derivatives such as (4-(4-Methyl-2-(4-trifluoromethyl-phenyl)-thiazol-5-ylmethylsulfanyl)-5-oxo -5,6,7,8-tetrahydro-naphthalen-1-yloxy)-acetic acid CHENG XUE-MIN (US) 2003-11-06 US disclosed
WO-2003074052-A1 THIAZOLE AND OXAZOLE DERIVATIVES THAT MODULATE PPAR ACTIVITY WARNER-LAMBERT COMPANY LLC (US) 2003-09-12 WO 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-20030207916-A1 Thiazole or oxazole derivatives such as (4-(4-Methyl-2-(4-trifluoromethyl-phenyl)-thiazol-5-ylmethylsulfanyl)-5-oxo -5,6,7,8-tetrahydro-naphthalen-1-yloxy)-acetic acid PPARA, PPARD, PPARG PPARD 2/4885PPARA 1/4885PPARG 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.