SCHEMBL22135397

SCHEMBL22135397

CC1(C)OB(c2cccc3c2sc2ccc(-c4ccc5sc6ccccc6c5c4)cc23)OC1(C)C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.39
LIPG Q9Y5X9 4/20 0.37
LPL P06858 3/20 0.37
GPR3 P46089 1/20 0.35
PTGIR P43119 1/20 0.33
MAPT P10636 5/20 0.33
PTPN7 P35236 1/20 0.32
DUSP3 P51452 1/20 0.32
PTPN12 Q05209 1/20 0.32
PTPN22 Q9Y2R2 1/20 0.32
PARP14 Q460N5 1/20 0.32
LIMK1 P53667 1/20 0.32
ALDH1A1 P00352 3/20 0.31
HPGD P15428 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
PIM3 Q86V86 1/20 0.31
POLB P06746 2/20 0.31
L3MBTL1 Q9Y468 2/20 0.31
TNKS O95271 1/20 0.31

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
SCHEMBL22701851 0.93 LIPG (0.46) ALOX5LIPGLPLLIMK1PIM3
SCHEMBL22701782 0.93 LIPG (0.46) ALOX5LIPGLPLLIMK1PIM3
SCHEMBL24786947 0.93 LIPG (0.37) ALOX5LIPGLPLLIMK1
SCHEMBL22701808 0.91 LIPG (0.44) ALOX5LIPGLPLLIMK1PIM3
SCHEMBL22701867 0.90 LIPG (0.43) ALOX5LIPGLPLLIMK1PIM3
SCHEMBL5019783 0.89 GPR3 (0.39) ALOX5LIPGLPLGPR3MAPT
SCHEMBL22701844 0.87 LPL (0.44) ALOX5LIPGLPLALDH1A1HPGD
SCHEMBL22701890 0.86 ALOX5 (0.38) ALOX5LIPGLPLPRKDC
SCHEMBL20961306 0.85 LIPG (0.36) LIPGLPLGPR3MAPTPTPN7
SCHEMBL18090450 0.85 LIPG (0.46) ALOX5LIPGLPLLIMK1PIM3

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
WO-2020130509-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME 두산솔루스 주식회사 2020-06-25 WO disclosed