SCHEMBL5326327

SCHEMBL5326327

O=C1CNC(=O)N1c1cc(Cl)c(Oc2ccc(O)c(-c3ccccc3)c2)c(Cl)c1

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
THRB P10828 18/20 0.55
THRA P10827 16/20 0.55
EPHX1 P07099 2/20 0.42
EPHX2 P34913 2/20 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
SCHEMBL5326116 0.85 THRB (0.39) THRBTHRA
SCHEMBL5333107 0.82 THRB (0.50) THRBTHRA
SCHEMBL5329537 0.81 THRB (0.43) THRBTHRAEPHX1EPHX2
SCHEMBL5326041 0.80 THRB (0.57) THRBTHRA
SCHEMBL5327219 0.80 THRB (0.53) THRBTHRA
SCHEMBL5326324 0.79 THRB (0.55) THRBTHRAEPHX1EPHX2
SCHEMBL5325041 0.78 THRB (0.39) THRBTHRA
SCHEMBL5398710 0.77 THRB (0.42) THRBTHRA
SCHEMBL5326814 0.77 THRB (0.46) THRBTHRA
SCHEMBL5330303 0.76 THRB (0.40) 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-2007132475-A1 SELECTIVE TR-BETA 1 AGONIST CADILA HEALTHCARE LIMITED (IN) 2007-11-22 WO claimed
WO-2007132475-A1 SELECTIVE TR-BETA 1 AGONIST CADILA HEALTHCARE LIMITED (IN) 2007-11-22 WO disclosed