SCHEMBL237352

SCHEMBL237352

S=C(SSC(=S)c1ccc(-c2ccccc2)cc1)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.46
MAPT P10636 3/20 0.46
WDR5 P61964 1/20 0.46
NCOA3 Q9Y6Q9 3/20 0.44
FAAH O00519 1/20 0.44
MGLL Q99685 1/20 0.44
MMP3 P08254 1/20 0.44
BCL2L1 Q07817 1/20 0.44
RAB9A P51151 3/20 0.43
NPC1 O15118 2/20 0.43
CTDSP1 Q9GZU7 1/20 0.43
ALDH1A1 P00352 4/20 0.43
L3MBTL1 Q9Y468 2/20 0.42
PTPN1 P18031 1/20 0.42
GSK3B P49841 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
LMNA P02545 2/20 0.41
CDC25B P30305 1/20 0.41
ATM Q13315 1/20 0.41

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
SCHEMBL176121 0.85 ALDH1A1 (0.44) MAPTFAAHMGLLALDH1A1L3MBTL1
SCHEMBL16300509 0.82 SMN1; SMN2 (0.48) SMN1; SMN2MAPTWDR5NCOA3FAAH
SCHEMBL3282739 0.77 SMN1; SMN2 (0.52) SMN1; SMN2MAPTWDR5NCOA3FAAH
SCHEMBL1478889 0.77 SMN1; SMN2 (0.52) SMN1; SMN2MAPTWDR5NCOA3FAAH
SCHEMBL6721066 0.77 SMN1; SMN2 (0.44) SMN1; SMN2MAPTWDR5NCOA3FAAH
SCHEMBL2838543 0.76 SMN1; SMN2 (0.56) SMN1; SMN2MAPTWDR5MGLLMMP3
SCHEMBL6721001 0.76 CA12 (0.52) SMN1; SMN2MAPTWDR5NCOA3ALDH1A1
SCHEMBL4253421 0.75 RAB9A (0.52) SMN1; SMN2MAPTWDR5NCOA3FAAH
SCHEMBL6191835 0.74 RAB9A (0.56) SMN1; SMN2MAPTWDR5MGLLMMP3
SCHEMBL11741123 0.73 ALDH1A1 (0.39) MAPTFAAHMGLLALDH1A1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9745406-B2 Curable composition CEMEDINE CO., LTD. (JP) 2017-08-29 US disclosed
EP-2412756-B1 CURABLE COMPOSITION CEMEDINE CO LTD (JP) 2016-12-21 EP disclosed
EP-2412756-A1 CURABLE COMPOSITION CEMEDINE CO., LTD. (JP) 2012-02-01 EP disclosed
US-20120004371-A1 CURABLE COMPOSITION CEMEDINE CO., LTD. (JP) 2012-01-05 US disclosed