SCHEMBL5073565

SCHEMBL5073565

CCCc1cc(C)c2cc(Oc3c(Br)cccc3Br)ccc2n1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.38
POLB P06746 1/20 0.36
PDE10A Q9Y233 2/20 0.35
ALDH1A1 P00352 3/20 0.34
HPGD P15428 2/20 0.34
HSD17B10 Q99714 1/20 0.34
PLA2G2A P14555 1/20 0.34
BCHE P06276 3/20 0.33
ACHE P22303 3/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
TDP1 Q9NUW8 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
LMNA P02545 1/20 0.33
TP53 P04637 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
SLC2A1 P11166 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
SCHEMBL3137560 0.85 THRA (0.46) KDM4EPOLBALDH1A1HPGDHSD17B10
SCHEMBL3145813 0.82 THRA (0.52) KDM4EPOLBHPGD
SCHEMBL3138058 0.82 THRA (0.41) KDM4EALDH1A1HPGDPLA2G2AMAPT
SCHEMBL5074377 0.82 CYP1A2 (0.46) KDM4EPOLBALDH1A1HPGDHSD17B10
SCHEMBL3138737 0.81 MCHR1 (0.42)
SCHEMBL3138746 0.81 MCHR1 (0.42)
SCHEMBL3137511 0.80 THRA (0.52) MAPT
SCHEMBL3140915 0.79 THRA (0.38) KDM4EPLA2G2A
SCHEMBL3138206 0.79 THRB (0.42)
SCHEMBL3145897 0.74 THRA (0.52) KDM4EPOLBHPGD

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