SCHEMBL282220

SCHEMBL282220

CCC(CC)(Oc1cc(C)c(Cc2ccc(OCOC)c(C=O)c2)c(C)c1)P(=O)(O)O

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
THRB P10828 11/20 0.40
THRA P10827 10/20 0.40
KDM4E B2RXH2 1/20 0.33
RAB9A P51151 1/20 0.33
S1PR2 O95136 1/20 0.32
S1PR1 P21453 1/20 0.32
S1PR3 Q99500 1/20 0.32
LPAR2 Q9HBW0 1/20 0.32
BACE1 P56817 1/20 0.31
TUBB1 Q9H4B7 1/20 0.30
ATM Q13315 1/20 0.30

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
SCHEMBL282900 0.86 THRB (0.41) THRBTHRARAB9A
SCHEMBL282808 0.85 THRA (0.44) THRBTHRA
SCHEMBL282339 0.85 THRB (0.43) THRBTHRAKDM4E
SCHEMBL281866 0.84 THRB (0.50) THRBTHRA
SCHEMBL282859 0.84 THRB (0.40) THRBTHRA
SCHEMBL285734 0.84 THRB (0.40) THRBTHRAKDM4E
SCHEMBL282656 0.84 THRB (0.40) THRBTHRAATM
SCHEMBL281846 0.84 THRB (0.58) THRBTHRAKDM4ERAB9AS1PR2
SCHEMBL282094 0.83 THRB (0.39) THRBTHRA
SCHEMBL282018 0.82 THRB (0.41) 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
EP-2428516-A1 Novel phosphorus-containing thyromimetics Metabasis Therapeutics, Inc. (US) 2012-03-14 EP disclosed
US-20090028925-A1 Novel Phosphinic Acid-Containing Thyromimetics METABASIS THERAPEUTICS, INC. 2009-01-29 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-20090028925-A1 Novel Phosphinic Acid-Containing Thyromimetics PYGL, PHOSPHO1, LIPE THRB 41/4885THRA 14/4885KDM4E 4083/4885

“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.