SCHEMBL2657064

SCHEMBL2657064

COC(=O)c1cc(OCc2ccccc2)cc(OC(C)(C)OC(F)F)c1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.51
HPGD P15428 1/20 0.51
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
MRGPRX4 Q96LA9 2/20 0.48
MAOB P27338 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HIF1A Q16665 1/20 0.43
NR4A2 P43354 1/20 0.42
ADRB2 P07550 1/20 0.42
ADRB1 P08588 1/20 0.42
ADRB3 P13945 1/20 0.42
SMPD1 P17405 1/20 0.42
LNPEP Q9UIQ6 2/20 0.41
GCK P35557 1/20 0.41
SPHK2 Q9NRA0 1/20 0.41
SPHK1 Q9NYA1 1/20 0.41
PTPN1 P18031 1/20 0.40

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
SCHEMBL2656402 0.90 MEN1 (0.64) MEN1KMT2AMRGPRX4MAOBNR4A2
SCHEMBL2656457 0.87 LMNA (0.56) LMNAHPGDMEN1KMT2AMRGPRX4
SCHEMBL4924745 0.83 LMNA (0.58) LMNAHPGDMEN1KMT2AMRGPRX4
SCHEMBL391547 0.83 MEN1 (0.71) LMNAHPGDMEN1KMT2AMRGPRX4
SCHEMBL2657646 0.83 LMNA (0.49) LMNAHPGDMEN1KMT2AMRGPRX4
SCHEMBL2657040 0.81 CA1 (0.53) LMNAHPGDMRGPRX4
SCHEMBL183994 0.80 LMNA (0.70) LMNAHPGDMEN1KMT2AMRGPRX4
SCHEMBL2657812 0.80 GCK (0.54) MEN1KMT2AGCK
SCHEMBL3599122 0.80 LMNA (0.53) LMNAHPGDMEN1KMT2AMRGPRX4
SCHEMBL29788280 0.79 LMNA (0.65) LMNAHPGDMEN1KMT2AMRGPRX4

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-2078000-A1 BENZOYL AMINO HETEROCYCLYL COMPOUNDS AS GLUCOKINASE (GLK) ACTIVATORS AstraZeneca AB (SE) 2009-07-15 EP disclosed
WO-2008050117-A1 BENZOYL AMINO HETEROCYCLYL COMPOUNDS AS GLUCOKINASE (GLK) ACTIVATORS ASTRAZENECA AB (SE) 2008-05-02 WO disclosed