SCHEMBL806822

SCHEMBL806822

CC1(C)OB(c2cccc(-c3cc(-c4cccc(-c5ccccc5)c4)cc(-c4cccc(-c5ccccc5)c4)c3)c2)OC1(C)C

nearest known ligand 0.66

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 11/20 0.66
LPL P06858 10/20 0.66
P4HB P07237 1/20 0.38
DGAT1 O75907 1/20 0.36
IRAK4 Q9NWZ3 1/20 0.36
PDGFRB P09619 1/20 0.36
KDR P35968 1/20 0.36
KEAP1 Q14145 1/20 0.35
NFE2L2 Q16236 1/20 0.35
ROCK1 Q13464 1/20 0.34
MAOA P21397 1/20 0.34
KMO O15229 1/20 0.34

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
SCHEMBL18371194 1.00 LIPG (0.66) LIPGLPLP4HBDGAT1IRAK4
SCHEMBL806548 1.00 LIPG (0.66) LIPGLPLP4HBDGAT1IRAK4
SCHEMBL29561139 1.00 LIPG (0.66) LIPGLPLP4HBDGAT1IRAK4
SCHEMBL806567 1.00 LIPG (0.66) LIPGLPLP4HBDGAT1IRAK4
SCHEMBL18134365 1.00 LIPG (0.66) LIPGLPLP4HBDGAT1IRAK4
SCHEMBL24768646 0.98 LIPG (0.69) LIPGLPLP4HBDGAT1IRAK4
SCHEMBL18371175 0.98 LIPG (0.69) LIPGLPLP4HBDGAT1IRAK4
SCHEMBL18371180 0.98 LIPG (0.69) LIPGLPLP4HBDGAT1IRAK4
SCHEMBL18270362 0.98 LIPG (0.69) LIPGLPLP4HBDGAT1IRAK4
SCHEMBL18134362 0.98 LIPG (0.69) LIPGLPLP4HBDGAT1IRAK4

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
US-20130175519-A1 NEW CONDENSED POLYCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT USING THE SAME CANON KABUSHIKI KAISHA (JP) 2013-07-11 US disclosed
US-20130175519-A1 NEW CONDENSED POLYCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT USING THE SAME CANON KABUSHIKI KAISHA (JP) 2013-07-11 US disclosed
WO-2012035962-A1 NEW CONDENSED POLYCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT USING THE SAME CANON KABUSHIKI KAISHA (JP) 2012-03-22 WO disclosed