SCHEMBL3712010

SCHEMBL3712010

CCOC(=O)CN(C(=O)c1cccc(C)c1)c1cc(Br)c(Oc2ccc(OC)c(C(C)C)c2)c(Br)c1

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 1/20 0.46
THRB P10828 12/20 0.42
THRA P10827 8/20 0.42
RORC P51449 4/20 0.40
HTT P42858 1/20 0.36
CTNNB1 P35222 1/20 0.35
WNT3A P56704 1/20 0.35

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
SCHEMBL3710974 0.93 THRB (0.42) NR3C1THRBTHRARORCHTT
SCHEMBL3703153 0.92 THRB (0.45) NR3C1THRBTHRARORC
SCHEMBL3709210 0.92 THRB (0.41) NR3C1THRBTHRARORC
SCHEMBL3706479 0.90 RORC (0.51) NR3C1THRBTHRARORCHTT
SCHEMBL3707754 0.90 THRB (0.44) THRBTHRARORC
SCHEMBL3705224 0.86 THRB (0.43) NR3C1THRBTHRARORC
SCHEMBL3710607 0.86 THRB (0.42) NR3C1THRBTHRARORC
SCHEMBL3706682 0.86 THRB (0.39) THRBTHRARORC
SCHEMBL3713108 0.85 THRB (0.41) THRBTHRARORC
SCHEMBL3708836 0.85 THRB (0.50) NR3C1THRBTHRARORC

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
WO-2010086878-A2 THYROID RECEPTOR MODULATORS CADILA HEALTHCARE LIMITED (IN) 2010-08-05 WO disclosed