SCHEMBL5329530

SCHEMBL5329530

CCc1cc(Oc2c(Cl)cc(N3CC(=O)NC3=O)cc2Cl)ccc1O

nearest known ligand 0.43

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
THRB P10828 17/20 0.43
THRA P10827 10/20 0.43

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
SCHEMBL5324510 0.87 THRB (0.38) THRBTHRA
SCHEMBL5326809 0.86 THRB (0.46) THRBTHRA
SCHEMBL5333104 0.86 THRB (0.51) THRBTHRA
SCHEMBL5326037 0.84 THRB (0.57) THRBTHRA
SCHEMBL5327217 0.84 THRB (0.53) THRBTHRA
SCHEMBL5328330 0.83 THRB (0.43) THRBTHRA
SCHEMBL5327228 0.82 THRB (0.42) THRBTHRA
SCHEMBL5326324 0.81 THRB (0.55) THRBTHRA
SCHEMBL5330145 0.81 THRB (0.47) THRBTHRA
SCHEMBL5326045 0.81 THRB (0.44) 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