SCHEMBL6036002

SCHEMBL6036002

Cc1nn(-c2ccc(C(F)(F)F)cn2)cc1COc1cccc(CC(=O)O)c1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 4/20 0.45
NR1H3 Q13133 4/20 0.45
RXRA P19793 1/20 0.45
EGLN1 Q9GZT9 1/20 0.42
PTGDR2 Q9Y5Y4 2/20 0.41
IDE P14735 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
PPARD Q03181 6/20 0.41
PPARA Q07869 6/20 0.41
PPARG P37231 4/20 0.41
DGAT1 O75907 1/20 0.40
MRGPRX4 Q96LA9 2/20 0.40
MAOB P27338 1/20 0.39
NR4A2 P43354 1/20 0.39
ALKBH1 Q13686 1/20 0.39

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
SCHEMBL6035650 0.90 PLA2G4B (0.39) NR1H2NR1H3RXRAEGLN1IDE
SCHEMBL6036389 0.89 NR1H2 (0.44) NR1H2NR1H3RXRAEGLN1PTGDR2
SCHEMBL6036203 0.88 NR1H2 (0.43) NR1H2NR1H3RXRAEGLN1PTGDR2
SCHEMBL6218738 0.86 SMN1; SMN2 (0.44) EGLN1IDESMN1; SMN2MAOB
SCHEMBL6035801 0.85 PPARD (0.45) EGLN1IDESMN1; SMN2PPARDPPARA
SCHEMBL6036208 0.84 DGAT1 (0.41) NR1H2NR1H3RXRAEGLN1PTGDR2
SCHEMBL6034690 0.83 PPARD (0.48) PTGDR2SMN1; SMN2PPARDPPARAPPARG
SCHEMBL6035924 0.82 SMN1; SMN2 (0.39) NR1H2NR1H3RXRAEGLN1IDE
SCHEMBL6035082 0.81 PPARD (0.52) NR1H2NR1H3RXRAPTGDR2PPARD
SCHEMBL6035959 0.81 PLA2G4B (0.42) NR1H2NR1H3RXRAEGLN1IDE

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-20060148858-A1 1, 2-Azole derivatives with hypoglycemic and hypolipidemic activity TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-07-06 US disclosed
EP-1513817-A1 1, 2-AZOLE DERIVATIVES WITH HYPOGLYCEMIC AND HYPOLIPIDEMIC ACTIVITY Takeda Pharmaceutical Company Limited (JP) 2005-03-16 EP disclosed
WO-2003099793-A9 1,2-AZOLE DERIVATIVES WITH HYPOGLYCEMIC AND HYPOLIPIDEMIC ACTIVITY TAKEDA PHARMACEUTICAL (JP) 2005-02-10 WO disclosed
WO-2003099793-A1 1,2-AZOLE DERIVATIVES WITH HYPOGLYCEMIC AND HYPOLIPIDEMIC ACTIVITY TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2003-12-04 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-20060148858-A1 1, 2-Azole derivatives with hypoglycemic and hypolipidemic activity GPR119, SLC5A1, CYP4B1 NR1H2 12/4885NR1H3 4/4885RXRA 183/4885

“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.