SCHEMBL31095015

SCHEMBL31095015

[2H]c1c([2H])c([2H])c(-c2nc(CC([2H])([2H])Oc3ccc(/C=C(\OC)C(=O)OC)c4sccc34)c(C)o2)c([2H])c1[2H]

nearest known ligand 0.46

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARG P37231 20/20 0.46
PPARA Q07869 20/20 0.46
PPARD Q03181 6/20 0.46

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
SCHEMBL31094994 0.95 PPARG (0.42) PPARGPPARAPPARD
SCHEMBL30193346 0.95 PPARG (0.48) PPARGPPARAPPARD
SCHEMBL31095003 0.94 PPARG (0.50) PPARGPPARAPPARD
SCHEMBL31095009 0.94 PPARG (0.51) PPARGPPARAPPARD
SCHEMBL31095028 0.91 PPARG (0.56) PPARGPPARAPPARD
SCHEMBL30193393 0.90 PPARG (0.43) PPARGPPARAPPARD
SCHEMBL31095023 0.89 PPARG (0.46) PPARGPPARAPPARD
SCHEMBL30193247 0.89 PPARG (0.50) PPARGPPARAPPARD
SCHEMBL31095025 0.88 PPARG (0.53) PPARGPPARAPPARD
SCHEMBL31094998 0.87 PPARG (0.55) PPARGPPARAPPARD

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-20240270731-A1 DEUTERATED COMPOUNDS ALEBUND PHARMACEUTICALS (HONG KONG) LIMITED (CN) 2024-08-15 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-20240270731-A1 DEUTERATED COMPOUNDS CYP2D6, CYP11B2, DHCR7 PPARG 451/4885PPARA 601/4885PPARD 155/4885

“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.