SCHEMBL3781445

SCHEMBL3781445

CC(C)c1cc(Oc2c(Br)cc(N(c3ccccc3)C(C)C(=O)O)cc2Br)ccc1O

nearest known ligand 0.63

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
THRA P10827 14/20 0.63
THRB P10828 14/20 0.63

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 0.86 THRA (0.65) THRATHRB
SCHEMBL5964843 0.80 THRA (0.73) THRATHRB
SCHEMBL3707431 0.78 THRA (0.59) THRATHRB
SCHEMBL3787708 0.78 THRA (0.59) THRATHRB
SCHEMBL5619285 0.78 THRA (1.00) THRATHRB
SCHEMBL5618153 0.77 THRA (0.64) THRATHRB
SCHEMBL3707265 0.77 THRA (0.53) THRATHRB
SCHEMBL3708160 0.77 THRA (0.61) THRATHRB
SCHEMBL7955376 0.77 THRA (0.72) THRATHRB
SCHEMBL4566518 0.77 THRA (0.72) THRATHRB

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