SCHEMBL5073545

SCHEMBL5073545

CNC(=O)Cn1nc2ccc(Oc3c(Br)cc(NCC(=O)O)cc3Br)cc2c1C.Cc1c2cc(Oc3c(Br)cc(NCC(=O)O)cc3Br)ccc2nn1CS(C)(=O)=O

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
THRA P10827 4/20 0.35
THRB P10828 4/20 0.35
LMNA P02545 1/20 0.30
TP53 P04637 1/20 0.30
POLB P06746 1/20 0.30

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
SCHEMBL3137690 0.93 THRA (0.38) THRATHRBLMNATP53POLB
SCHEMBL3137713 0.93 THRA (0.36) THRATHRB
SCHEMBL3141376 0.84 THRB (0.50) THRATHRB
SCHEMBL3136329 0.81 THRB (0.37) THRATHRB
SCHEMBL3127279 0.80 THRA (0.41) THRATHRB
SCHEMBL5072164 0.77 THRB (0.39) THRATHRB
SCHEMBL3129766 0.77 P2RX7 (0.40) THRATHRBLMNA
SCHEMBL3145862 0.72 THRA (0.40) THRATHRB
SCHEMBL5072169 0.70 THRA (0.34) THRATHRBLMNA
Glycine SCHEMBL5076583 0.69 THRA (0.38) 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
EP-1899309-A1 HETEROCYCLIC COMPOUNDS AS AGONISTS FOR THE THYROID RECEPTOR KARO BIO AB (SE) 2008-03-19 EP disclosed
WO-2007003419-A1 HETEROCYCLIC COMPOUNDS AS AGONISTS FOR THE THYROID RECEPTOR KARO BIO AB (SE) 2007-01-11 WO disclosed