SCHEMBL7123493

SCHEMBL7123493

Clc1cc(Cl)c(Cl)c(-c2nc(-c3ccccc3)c(-c3ccccc3)n2-n2cnc(-c3ccccc3)c2-c2ccccc2)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.35
MGAM O43451 3/20 0.35
SI P14410 3/20 0.35
MGAM2 Q2M2H8 3/20 0.35
HSD11B1 P28845 1/20 0.34
NSD3 Q9BZ95 1/20 0.33
MDM4 O15151 1/20 0.33
TP53 P04637 1/20 0.33
MDM2 Q00987 1/20 0.33
AKT1 P31749 1/20 0.33
AKT2 P31751 1/20 0.33
SCN2A Q99250 1/20 0.33
PTGS2 P35354 1/20 0.33
BCHE P06276 1/20 0.32
ACHE P22303 1/20 0.32
KDM4E B2RXH2 1/20 0.32
LMNA P02545 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
CA12 O43570 1/20 0.32
CA1 P00915 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
SCHEMBL6370851 0.88 GAA (0.40) GAAMGAMSIMGAM2HSD11B1
SCHEMBL4622519 0.85 HSD11B1 (0.41) HSD11B1NSD3PTGS2BCHEACHE
SCHEMBL28919625 0.77 NSD3 (0.37) GAAMGAMSIMGAM2NSD3
SCHEMBL2689067 0.76 HSD11B1 (0.54) GAAHSD11B1TP53KDM4ELMNA
SCHEMBL31467384 0.76 HSD11B1 (0.54) GAAHSD11B1TP53KDM4ELMNA
SCHEMBL28919628 0.74 KDM4E (0.49) GAAMGAMSIMGAM2NSD3
SCHEMBL29732755 0.72 HSD11B1 (0.49) HSD11B1TP53PTGS2BCHEACHE
SCHEMBL63728 0.72 HSD11B1 (0.49) HSD11B1TP53PTGS2BCHEACHE
SCHEMBL18037949 0.72 GUSB (0.40) GAAMGAMSIMGAM2AKT1
SCHEMBL5201695 0.70 LMNA (0.50) GAAMGAMSIMGAM2TP53

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0828182-B1 Storage-stable photoimageable compositions with improved leuco dye DU PONT (US) 2003-11-19 EP claimed