SCHEMBL2470744

SCHEMBL2470744

O=C(OS(c1ccccc1)(c1ccccc1)c1ccccc1)C12CC3CC(C1)CC(C(=O)OS(c1ccccc1)(c1ccccc1)c1ccccc1)(C3)C2

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA9 Q16790 2/20 0.45
ENPP3 O14638 1/20 0.45
CA2 P00918 1/20 0.45
ENPP1 P22413 1/20 0.45
ENPP2 Q13822 1/20 0.45
KDM4E B2RXH2 1/20 0.43
GAA P10253 2/20 0.42
ALDH1A1 P00352 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.40
P2RX7 Q99572 1/20 0.40
LMNA P02545 3/20 0.40
CA12 O43570 1/20 0.40
HSD11B1 P28845 2/20 0.39
HPGD P15428 1/20 0.39
MAPT P10636 1/20 0.39
XBP1 P17861 1/20 0.39
NPSR1 Q6W5P4 1/20 0.38
TSHR P16473 1/20 0.38
CNR2 P34972 1/20 0.38

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
SCHEMBL17292426 0.92 L3MBTL1 (0.50) CA9ENPP3CA2ENPP1ENPP2
SCHEMBL1977435 0.91 KDM4E (0.52) CA9ENPP3CA2ENPP1ENPP2
SCHEMBL5567915 0.78 GAA (0.58) KDM4EGAAALDH1A1L3MBTL1P2RX7
SCHEMBL5567903 0.74 GAA (0.54) KDM4EGAAL3MBTL1P2RX7LMNA
SCHEMBL16586710 0.69 CYP17A1 (0.42) CA9ENPP3CA2ENPP1ENPP2
SCHEMBL2472719 0.68 MEN1 (0.37) ENPP3ENPP1ENPP2ALDH1A1LMNA
SCHEMBL3454498 0.68 ALDH1A1 (0.51) CA9ENPP3CA2ENPP1ENPP2
SCHEMBL14651305 0.68 HSD11B1 (0.59) KDM4EGAAALDH1A1LMNAHSD11B1
SCHEMBL2252835 0.68 LMNA (0.66) GAAALDH1A1LMNAHSD11B1
SCHEMBL1634162 0.67 GAA (0.72) KDM4EGAAALDH1A1P2RX7LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2370859-A2 A PHOTOSENSITIVE COMPOSITION AZ Electronic Materials USA Corp. (US) 2011-10-05 EP disclosed
WO-2010064135-A2 A PHOTOSENSITIVE COMPOSITION AZ ELECTRONIC MATERIALS USA CORP. (US) 2010-06-10 WO disclosed
US-20100136477-A1 Photosensitive Composition AZ ELECTRONIC MATERIALS USA CORP. 2010-06-03 US disclosed