SCHEMBL3369900

SCHEMBL3369900

CCOC(Cc1ccc(OC(C)(C)c2sc(-c3ccc(C(F)(F)F)cc3)nc2C)cc1C)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 16/20 0.51
PPARD Q03181 14/20 0.51
PPARG P37231 9/20 0.51
FFAR1 O14842 2/20 0.44
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
HSP90AA1 P07900 1/20 0.42
MAPT P10636 1/20 0.42
CRHBP P24387 1/20 0.42
KMT2A Q03164 1/20 0.42
CRHR2 Q13324 1/20 0.42

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
SCHEMBL3368269 0.93 PPARD (0.49) PPARAPPARDPPARGFFAR1KDM4E
SCHEMBL3372154 0.88 PPARD (0.53) PPARAPPARDPPARGFFAR1
SCHEMBL3369920 0.86 PPARD (0.70) PPARAPPARDPPARGFFAR1
SCHEMBL3372135 0.86 PPARD (0.50) PPARAPPARDPPARGFFAR1KDM4E
SCHEMBL3370954 0.85 PPARD (0.50) PPARAPPARDPPARGFFAR1
SCHEMBL3371478 0.85 PPARG (0.46) PPARAPPARDPPARGKDM4EMEN1
SCHEMBL3371253 0.84 PPARD (0.50) PPARAPPARDPPARG
SCHEMBL6439387 0.84 PPARD (0.55) PPARAPPARDPPARGFFAR1
SCHEMBL3372358 0.83 PPARD (0.49) PPARAPPARDPPARGKDM4EMEN1
SCHEMBL3370233 0.82 PPARD (0.49) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1537091-B1 NOVEL 2-ARYLTHIAZOLE COMPOUNDS AS PPARALPHA AND PPARGAMMA AGONISTS HOFFMANN LA ROCHE (CH) 2010-10-06 EP disclosed
US-6809110-B2 NONINSULIN DEPENDENT DIABETES; SUCH AS 2-ETHOXY-3-(4-(2-(5-METHYL-2-PHENYL-THIAZOL-4-YL)-ETHOXY)-BENZO(B)THIOPHEN-7-YL)-PROPIONIC ACID HOFFMANN-LA ROCHE INC. 2004-10-26 US disclosed
US-20040110807-A1 Thiazole derivatives HOFFMANN-LA ROCHE INC. 2004-06-10 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-20040110807-A1 Thiazole derivatives SLC5A1, GPR119, INSR PPARA 287/4885PPARD 79/4885PPARG 181/4885

“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.