SCHEMBL28786151

SCHEMBL28786151

Cc1cc(OC(C)(C)C(=O)O)cc(C)c1Cc1ccc(O)c(C(C)C)c1

nearest known ligand 0.68

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
THRB P10828 19/20 0.68
THRA P10827 18/20 0.68
PPARG P37231 1/20 0.43
PPARA Q07869 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
SCHEMBL28786145 0.87 THRB (0.65) THRBTHRA
SCHEMBL28786164 0.86 THRB (0.59) THRBTHRA
SCHEMBL28786166 0.85 THRB (0.58) THRBTHRA
SCHEMBL4211548 0.83 THRB (0.69) THRBTHRA
SCHEMBL28786138 0.82 THRB (0.49) THRBTHRAPPARGPPARA
Sobetirome SCHEMBL29467327 0.81 THRB (1.00) THRBTHRA
Sobetirome SCHEMBL282119 0.81 THRB (1.00) THRBTHRA
SCHEMBL1525950 0.81 THRB (0.70) THRBTHRA
SCHEMBL10064689 0.80 THRB (0.69) THRBTHRA
SCHEMBL3159430 0.80 THRB (0.67) THRBTHRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114763363-B Phosphoric acid or phosphate derivative, preparation method thereof and application thereof in medicine 上海喀露蓝科技有限公司 2024-10-01 CN disclosed
CN-114763363-A Phosphoric acid or phosphate ester derivative, preparation method thereof and application thereof in medicine 上海喀露蓝科技有限公司 2022-07-19 CN disclosed