SCHEMBL5637580

SCHEMBL5637580

COC(=O)Cc1csc2cc(OCc3cccc(OCc4ccc(C(F)(F)F)cc4)c3)ccc12

nearest known ligand 0.73

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 9/20 0.73
PPARD Q03181 8/20 0.73
PPARG P37231 5/20 0.73
MAOB P27338 4/20 0.50
SLC2A1 P11166 1/20 0.49
MRGPRX4 Q96LA9 2/20 0.46
ADAM17 P78536 1/20 0.43
MAPT P10636 1/20 0.43
HTT P42858 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
NR4A2 P43354 1/20 0.43

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
SCHEMBL5639274 0.93 PPARA (0.81) PPARAPPARDPPARGMAOB
SCHEMBL5638550 0.90 PPARD (0.89) PPARAPPARDPPARGMAOBSLC2A1
SCHEMBL5640454 0.88 PPARD (0.67) PPARAPPARDPPARGMAOBSLC2A1
SCHEMBL5637891 0.83 PPARD (1.00) PPARAPPARDPPARGMAOBMRGPRX4
SCHEMBL5638404 0.82 PPARD (0.72) PPARAPPARDPPARGMAOBSLC2A1
SCHEMBL5641082 0.81 PPARA (0.60) PPARAPPARDPPARGMAOBMRGPRX4
SCHEMBL5802559 0.80 PPARA (0.85) PPARAPPARDPPARG
SCHEMBL5638911 0.79 PPARD (0.55) PPARAPPARDPPARGMAOBSLC2A1
SCHEMBL5858872 0.79 PPARD (0.86) PPARAPPARDPPARG
SCHEMBL5639705 0.79 PPARD (0.82) PPARAPPARDPPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7244763-B2 Compounds that modulate PPAR activity and methods of preparation WARNER LAMBERT COMPANY LLC (US) 2007-07-17 US disclosed
US-7244763-B2 Compounds that modulate PPAR activity and methods of preparation WARNER LAMBERT COMPANY LLC (US) 2007-07-17 US disclosed
US-7244763-B2 Compounds that modulate PPAR activity and methods of preparation WARNER LAMBERT COMPANY LLC (US) 2007-07-17 US disclosed
EP-1620086-A1 COMPOUNDS THAT MODULATE PPAR ACTIVITY AND METHODS OF PREPARATION Warner-Lambert Company LLC (US) 2006-02-01 EP disclosed
US-6875780-B2 Compounds that modulate PPAR activity and methods for their preparation WARNER-LAMBERT COMPANY (US) 2005-04-05 US disclosed
WO-2004091604-A1 COMPOUNDS THAT MODULATE PPAR ACTIVITY AND METHODS OF PREPARATION WARNER-LAMBERT COMPANY LLC (US) 2004-10-28 WO disclosed
US-20040209936-A1 Compounds that modulate PPAR activity and methods of preparation BRATTON LARRY D (US) 2004-10-21 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-20040209936-A1 Compounds that modulate PPAR activity and methods of preparation 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.