SCHEMBL4963467

SCHEMBL4963467

[CH2]c1cc(C)c(Cc2ccc(O)c(C(C)C)c2)c(C)c1

nearest known ligand 0.64

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
THRB P10828 19/20 0.64
THRA P10827 18/20 0.64
ESR1 P03372 1/20 0.43
ESR2 Q92731 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
SCHEMBL25773018 0.88 THRB (0.71) THRBTHRAESR1ESR2
SCHEMBL328377 0.88 THRB (0.67) THRBTHRAESR1ESR2
SCHEMBL1457668 0.85 THRB (0.67) THRBTHRAESR1ESR2
SCHEMBL27702889 0.85 THRB (0.64) THRBTHRAESR1ESR2
SCHEMBL28769044 0.84 THRB (0.67) THRBTHRA
SCHEMBL12824810 0.84 THRB (0.67) THRBTHRAESR1ESR2
SCHEMBL10064689 0.82 THRB (0.69) THRBTHRA
SCHEMBL4196757 0.82 THRB (0.61) THRBTHRAESR1ESR2
Hydrochloric Acid SCHEMBL1458369 0.82 THRB (0.65) THRBTHRAESR1ESR2
SCHEMBL13557776 0.82 THRB (0.60) THRBTHRAESR1ESR2

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
CN-101189248-A Novel phosphorus-containing thyromimetics METABASIS THERAPEUTICS INC (US) 2008-05-28 CN disclosed
CN-101180097-A Novel phosphinic acid-containing thyromimetics METABASIS THERAPEUTICS INC (US) 2008-05-14 CN disclosed
EP-1890768-A2 NOVEL PHOSPHINIC ACID-CONTAINING THYROMIMETICS Metabasis Therapeutics, Inc. (US) 2008-02-27 EP disclosed
WO-2006128056-A2 NOVEL PHOSPHINIC ACID-CONTAINING THYROMIMETICS METABASIS THERAPEUTICS, INC. (US) 2006-11-30 WO disclosed