SCHEMBL3884343

SCHEMBL3884343

COCOc1ccc(C(=O)c2c(C)cc(OOP(C)(=O)O)cc2C)cc1C(C)C

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
THRB P10828 8/20 0.34
THRA P10827 6/20 0.34
PTGS1 P23219 1/20 0.32
PTGS2 P35354 1/20 0.32
LMNA P02545 1/20 0.31
POLB P06746 1/20 0.31
TAS1R3 Q7RTX0 3/20 0.31
TAS1R1 Q7RTX1 3/20 0.31
NPC1 O15118 1/20 0.30
USP2 O75604 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HSD17B10 Q99714 1/20 0.30
EGFR P00533 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
SCHEMBL3146786 0.88 THRB (0.47) THRBTHRAPTGS1PTGS2LMNA
SCHEMBL5135657 0.86 PTGS1 (0.33) THRBTHRAPTGS1PTGS2LMNA
SCHEMBL282207 0.82 LMNA (0.32) THRBTHRAPTGS1PTGS2LMNA
SCHEMBL28758420 0.81 CYP3A4 (0.38) THRBPTGS1PTGS2LMNANPC1
SCHEMBL8498059 0.73 THRB (0.49) THRBTHRAPTGS1PTGS2LMNA
SCHEMBL7114179 0.72 PTGS1 (0.50) PTGS1PTGS2LMNA
SCHEMBL13381631 0.72 THRB (0.56) THRBTHRA
SCHEMBL282132 0.70 THRB (0.66) THRBTHRA
SCHEMBL3160054 0.69 THRB (0.71) THRBTHRA
SCHEMBL3157770 0.68 THRA (0.46) THRBTHRALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7514419-B2 Phosphorus-containing thyromimetics METABASIS THERAPEUTICS, INC. (US) 2009-04-07 US disclosed
EP-1891080-A2 NOVEL PHOSPHORUS-CONTAINING THYROMIMETICS Metabasis Therapeutics, Inc. (US) 2008-02-27 EP disclosed
WO-2006128055-A2 NOVEL PHOSPHORUS-CONTAINING THYROMIMETICS METABASIS THERAPEUTICS, INC. (US) 2006-11-30 WO disclosed
US-20060046980-A1 Novel phosphorus-containing thyromimetics METABASIS THERAPEUTICS, INC. 2006-03-02 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-20060046980-A1 Novel phosphorus-containing thyromimetics PYGL, THRA, THOP1 THRB 6/4885THRA 2/4885PTGS1 1560/4885

“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.