SCHEMBL3707265

SCHEMBL3707265

CCC(C)c1cc(Oc2c(Br)cc(N(C(=O)c3ccccc3)C(C)C(=O)O)cc2Br)ccc1O

nearest known ligand 0.53

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
THRA P10827 15/20 0.53
THRB P10828 15/20 0.53

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
SCHEMBL3706436 0.91 THRA (0.65) THRATHRB
SCHEMBL3703969 0.88 THRA (0.53) THRATHRB
SCHEMBL3707431 0.86 THRA (0.59) THRATHRB
SCHEMBL3712191 0.86 THRA (0.51) THRATHRB
SCHEMBL3708924 0.84 THRB (0.49) THRATHRB
SCHEMBL3706695 0.81 THRB (0.42) THRATHRB
SCHEMBL3704041 0.79 THRA (0.54) THRATHRB
SCHEMBL3708160 0.78 THRA (0.61) THRATHRB
SCHEMBL3712504 0.77 THRA (0.49) THRATHRB
SCHEMBL3781445 0.77 THRA (0.63) THRATHRB

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