SCHEMBL3710103

SCHEMBL3710103

O=C(O)CN(C(=O)Nc1ccccc1)c1cc(Br)c(Oc2ccc(O)c(-c3ccccc3)c2)c(Br)c1

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
THRB P10828 15/20 0.50
THRA P10827 14/20 0.50
EPHX1 P07099 2/20 0.41
EPHX2 P34913 2/20 0.41
PTK2 Q05397 1/20 0.40

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
SCHEMBL3710195 0.88 THRB (0.60) THRBTHRAEPHX1EPHX2
SCHEMBL3784791 0.88 THRA (0.41) THRBTHRAPTK2
SCHEMBL3790055 0.87 THRA (0.45) THRBTHRA
SCHEMBL3701595 0.85 THRA (0.62) THRBTHRA
SCHEMBL3706305 0.83 THRB (0.53) THRBTHRA
SCHEMBL3707185 0.83 THRA (0.52) THRBTHRA
SCHEMBL3703818 0.82 THRB (0.47) THRBTHRA
SCHEMBL3706100 0.81 THRB (0.45) THRBTHRA
SCHEMBL3710196 0.81 THRB (0.49) THRBTHRA
SCHEMBL3704858 0.81 THRB (0.45) 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