SCHEMBL5072134

SCHEMBL5072134

Oc1cc(Br)c(Oc2ccc3nc(Cl)cc(Cl)c3c2)c(Br)c1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 3/20 0.38
ESR2 Q92731 3/20 0.38
ESRRB O95718 2/20 0.38
ESRRA P11474 2/20 0.38
THRA P10827 8/20 0.37
THRB P10828 8/20 0.37
HSP90AA1 P07900 1/20 0.36
NT5E P21589 1/20 0.35
KDM4E B2RXH2 1/20 0.34
KDM4A O75164 1/20 0.34
KDM5C P41229 1/20 0.34
KDM4D Q6B0I6 1/20 0.34
KDM4C Q9H3R0 1/20 0.34
SLC2A1 P11166 1/20 0.33
MAPT P10636 1/20 0.32
LMNA P02545 1/20 0.32

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
SCHEMBL5072132 0.86 NT5E (0.35) THRATHRBNT5EKDM4ESLC2A1
SCHEMBL5072138 0.85 L3MBTL1 (0.38) ESR1ESR2ESRRBESRRATHRA
SCHEMBL3140925 0.82 THRA (0.45) THRATHRBKDM4E
SCHEMBL5072159 0.78 THRB (0.39) ESR1ESR2ESRRBESRRATHRA
SCHEMBL3138232 0.78 SMN1; SMN2 (0.42) THRATHRB
SCHEMBL30827905 0.75 ACHE (0.49) THRATHRBKDM4ESLC2A1MAPT
SCHEMBL4745132 0.75 ACHE (0.49) THRATHRBKDM4ESLC2A1MAPT
SCHEMBL3140938 0.73 THRA (0.46) THRATHRBKDM4E
SCHEMBL5076613 0.73 KDM4E (0.41) ESR1ESR2THRATHRBKDM4E
SCHEMBL7692119 0.72 ESR1 (0.64) ESR1ESR2ESRRBESRRANT5E

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