SCHEMBL3702776

SCHEMBL3702776

CC(C)c1cc(Oc2c(Cl)cc(N(CC(=O)O)C(=O)Nc3ccccc3)cc2Cl)ccc1O

nearest known ligand 0.60

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
THRB P10828 11/20 0.58
THRA P10827 10/20 0.58
RORC P51449 1/20 0.47

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
SCHEMBL3701595 0.89 THRA (0.62) THRBTHRA
SCHEMBL3706464 0.87 THRA (0.61) THRBTHRA
SCHEMBL3708498 0.85 THRA (0.61) THRBTHRA
SCHEMBL3710195 0.85 THRB (0.60) THRBTHRA
SCHEMBL3707164 0.84 THRB (0.64) THRBTHRARORC
SCHEMBL3713885 0.82 THRA (0.57) THRBTHRA
SCHEMBL3704572 0.82 THRB (0.54) THRBTHRA
SCHEMBL3223233 0.82 THRA (0.69) THRBTHRA
SCHEMBL3221807 0.82 THRA (0.61) THRBTHRA
SCHEMBL3707185 0.81 THRA (0.52) 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