SCHEMBL7122037

SCHEMBL7122037

CC(=O)Oc1cc(Cl)c(Oc2ccc(NCc3ccccc3)cc2)c(Cl)c1C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 9/20 0.43
FFAR4 Q5NUL3 2/20 0.43
BCHE P06276 3/20 0.42
ACHE P22303 3/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
GAA P10253 2/20 0.41
TP53 P04637 1/20 0.41
MAPT P10636 1/20 0.41
THRB P10828 1/20 0.41
PPARG P37231 1/20 0.41
PPARA Q07869 1/20 0.41
HIF1A Q16665 1/20 0.41
GNA15 P30679 1/20 0.40
PTGER3 P43115 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
GLA P06280 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL5393174 0.78 MTNR1B (0.46) GAAMAPTTHRBALDH1A1LMNA
SCHEMBL5389109 0.77 CYP19A1 (0.39) GAAMAPTTHRBTDP1ALDH1A1
SCHEMBL5859473 0.77 RNF4 (0.41) GAATP53MAPTTHRBTDP1
SCHEMBL7122041 0.75 THRB (0.51) FFAR1FFAR4BCHEACHECA1
SCHEMBL5859386 0.74 FFAR1 (0.64) FFAR1FFAR4BCHEACHECA1
SCHEMBL5382492 0.73 MEN1 (0.46) GAAMAPTALDH1A1LMNAHTT
SCHEMBL5382504 0.73 BACE1 (0.42) GAATHRBTDP1ALDH1A1LMNA
SCHEMBL5385584 0.73 ICAM1 (0.35) ACHEGAAMAPTTHRBALDH1A1
SCHEMBL5388204 0.73 NR4A1 (0.39) ACHEGAAMAPTTHRBLMNA
SCHEMBL5455782 0.71 THRB (0.45) THRBTDP1ALDH1A1LMNAGLA

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-1358175-A2 PHENOXY SUBSTITUTED BENZOCONDENSED HETEROARYL DERIVATIVES AS THYROID RECEPTOR LIGANDS KARO BIO AB (SE) 2003-11-05 EP disclosed
WO-2002062780-A2 PHENOXY SUBSTITUTED BENZOCONDENSED HETEROARYL DERIVATIVES AS THYROID RECEPTOR LIGANDS KARO BIO AB (SE) 2002-08-15 WO disclosed