SCHEMBL6035801

SCHEMBL6035801

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

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 12/20 0.45
PPARA Q07869 11/20 0.45
PPARG P37231 8/20 0.45
SMN1; SMN2 Q16637 3/20 0.40
IDE P14735 1/20 0.40
EGLN1 Q9GZT9 1/20 0.38
MAPK1 P28482 2/20 0.37
KDM4E B2RXH2 1/20 0.37
LMNA P02545 1/20 0.37
HTT P42858 1/20 0.37
HSD17B10 Q99714 1/20 0.37
CYP4F2 P78329 1/20 0.37
CYP4A11 Q02928 1/20 0.37
HPGD P15428 1/20 0.37
MAOB P27338 1/20 0.37

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
SCHEMBL6035033 0.91 PPARA (0.52) PPARDPPARAPPARGSMN1; SMN2HPGD
SCHEMBL6035852 0.91 PPARA (0.44) PPARDPPARAPPARGSMN1; SMN2IDE
SCHEMBL6218738 0.87 SMN1; SMN2 (0.44) SMN1; SMN2IDEEGLN1MAPK1KDM4E
SCHEMBL6036002 0.85 NR1H2 (0.45) PPARDPPARAPPARGSMN1; SMN2IDE
SCHEMBL6034603 0.82 PPARA (0.41) PPARDPPARAPPARGSMN1; SMN2IDE
SCHEMBL6034617 0.81 PPARA (0.42) PPARDPPARAPPARGSMN1; SMN2IDE
SCHEMBL1634400 0.81 PPARA (0.40) PPARDPPARAPPARGSMN1; SMN2IDE
SCHEMBL6035851 0.81 PPARA (0.46) PPARDPPARAPPARGSMN1; SMN2IDE
SCHEMBL6035559 0.81 PPARA (0.40) PPARDPPARAPPARGSMN1; SMN2IDE
SCHEMBL6035156 0.81 PPARA (0.40) PPARDPPARAPPARGSMN1; SMN2IDE

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 1 patent. 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

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 PPARD 2488/4885PPARA 1717/4885PPARG 1037/4885

“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.