SCHEMBL28786136

SCHEMBL28786136

Cc1cc(OCC(=O)O[PH](=O)O)cc(C)c1Cc1ccc(O)c(C(C)C)c1

nearest known ligand 0.72

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
THRB P10828 20/20 0.72
THRA P10827 19/20 0.72

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
SCHEMBL28786135 0.93 THRB (0.74) THRBTHRA
SCHEMBL23625081 0.88 THRB (0.77) THRBTHRA
SCHEMBL18028293 0.86 THRB (0.77) THRBTHRA
SCHEMBL19655550 0.84 THRB (0.82) THRBTHRA
Sobetirome SCHEMBL282119 0.84 THRB (1.00) THRBTHRA
Sobetirome SCHEMBL29467327 0.84 THRB (1.00) THRBTHRA
SCHEMBL19859395 0.83 THRB (0.80) THRBTHRA
SCHEMBL19101128 0.83 THRB (0.72) THRBTHRA
SCHEMBL18002452 0.83 THRB (0.72) THRBTHRA
SCHEMBL18028276 0.83 THRB (0.72) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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