SCHEMBL3707754

SCHEMBL3707754

CCOC(=O)CN(C(=O)c1ccc(OC)cc1)c1cc(Br)c(Oc2ccc(OC)c(C(C)C)c2)c(Br)c1

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
THRB P10828 12/20 0.44
THRA P10827 9/20 0.44
RORC P51449 5/20 0.40
ALDH1A1 P00352 1/20 0.38

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
SCHEMBL3703153 0.94 THRB (0.45) THRBTHRARORC
SCHEMBL3713108 0.92 THRB (0.41) THRBTHRARORC
SCHEMBL3710974 0.91 THRB (0.42) THRBTHRARORCALDH1A1
SCHEMBL3712010 0.90 NR3C1 (0.46) THRBTHRARORC
SCHEMBL3709210 0.88 THRB (0.41) THRBTHRARORC
SCHEMBL3705224 0.88 THRB (0.43) THRBTHRARORC
SCHEMBL3706682 0.87 THRB (0.39) THRBTHRARORC
SCHEMBL3710607 0.87 THRB (0.42) THRBTHRARORC
SCHEMBL3708836 0.86 THRB (0.50) THRBTHRARORC
SCHEMBL3714503 0.85 LMNA (0.47) THRBTHRARORCALDH1A1

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