SCHEMBL5326324

SCHEMBL5326324

O=C1CN(c2cc(Cl)c(Oc3ccc(O)c(-c4ccccc4)c3)c(Cl)c2)C(=O)N1

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
THRB P10828 19/20 0.55
THRA P10827 17/20 0.55
EPHX1 P07099 1/20 0.40
EPHX2 P34913 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
SCHEMBL5326111 0.85 THRB (0.39) THRBTHRA
SCHEMBL5333104 0.83 THRB (0.51) THRBTHRA
SCHEMBL5329530 0.81 THRB (0.43) THRBTHRA
SCHEMBL5326037 0.80 THRB (0.57) THRBTHRA
SCHEMBL5327217 0.80 THRB (0.53) THRBTHRA
SCHEMBL5326327 0.79 THRB (0.55) THRBTHRAEPHX1EPHX2
SCHEMBL5325037 0.77 THRB (0.38) THRBTHRA
SCHEMBL5326809 0.77 THRB (0.46) THRBTHRA
SCHEMBL5327228 0.77 THRB (0.42) THRBTHRA
SCHEMBL5398709 0.76 THRB (0.42) 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