SCHEMBL3708924

SCHEMBL3708924

CC(C(=O)O)N(C(=O)c1ccccc1)c1cc(Br)c(Oc2ccc(O)c(Cc3ccccc3)c2)c(Br)c1

nearest known ligand 0.49

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
THRB P10828 16/20 0.49
THRA P10827 15/20 0.49
SLC7A5 Q01650 1/20 0.42

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
SCHEMBL3706436 0.85 THRA (0.65) THRBTHRA
SCHEMBL3709651 0.84 THRB (0.52) THRBTHRA
SCHEMBL3707265 0.84 THRA (0.53) THRBTHRA
SCHEMBL3704031 0.79 THRB (0.38) THRBTHRA
SCHEMBL3707431 0.77 THRA (0.59) THRBTHRA
SCHEMBL2170241 0.76 THRA (0.47) THRBTHRA
SCHEMBL2170237 0.76 THRA (0.47) THRBTHRA
SCHEMBL3708122 0.76 THRB (0.45) THRBTHRA
SCHEMBL3705094 0.74 THRB (0.49) THRBTHRASLC7A5
SCHEMBL2169569 0.72 THRA (0.46) 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
WO-2010086878-A2 THYROID RECEPTOR MODULATORS CADILA HEALTHCARE LIMITED (IN) 2010-08-05 WO claimed
WO-2010086878-A2 THYROID RECEPTOR MODULATORS CADILA HEALTHCARE LIMITED (IN) 2010-08-05 WO disclosed