SCHEMBL328373

SCHEMBL328373

CC(C)c1cc(Cc2c(Cl)cc(OCP(O)O)cc2Cl)cc(Br)c1O

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
THRB P10828 16/20 0.47
THRA P10827 15/20 0.47
DHFR P00374 1/20 0.32
GABRA1 P14867 2/20 0.32
GABRB1 P18505 2/20 0.32
GSR P00390 1/20 0.31

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
SCHEMBL3156775 0.82 THRA (0.53) THRBTHRA
SCHEMBL13381681 0.81 THRA (0.47) THRBTHRA
SCHEMBL281980 0.75 THRA (0.41) THRBTHRA
SCHEMBL23462762 0.69 THRB (0.69) THRBTHRA
SCHEMBL21565924 0.68 THRA (0.53) THRBTHRA
SCHEMBL21286536 0.68 THRB (0.76) THRBTHRA
SCHEMBL27713138 0.66 THRB (0.41) THRBTHRADHFRGABRA1GABRB1
SCHEMBL24632149 0.65 THRB (0.71) THRBTHRA
SCHEMBL4603030 0.65 GABRA1 (0.53) THRBTHRADHFRGABRA1GABRB1
SCHEMBL24132760 0.64 THRA (0.69) 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
EP-2428516-A1 Novel phosphorus-containing thyromimetics Metabasis Therapeutics, Inc. (US) 2012-03-14 EP disclosed