SCHEMBL12020082

SCHEMBL12020082

C=C1OB(c2cc(CCCCCC)c(B3OC(=C)C(C)(C)O3)cc2CCCCCC)OC1(C)C

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ LIPG Q9Y5X9 6/20 0.38
▸ LPL P06858 5/20 0.38
▸ ALOX5 P09917 4/20 0.33
▸ TYR P14679 2/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ PTGS2 P35354 3/20 0.30

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
SCHEMBL18025836 0.79 LIPG (0.55) LIPGLPLALOX5TYRMEN1
SCHEMBL12234041 0.79 LIPG (0.55) LIPGLPLALOX5TYRMEN1
SCHEMBL1336781 0.79 LIPG (0.55) LIPGLPLALOX5TYRMEN1
SCHEMBL12651429 0.78 LIPG (0.37) LIPGLPL
SCHEMBL29591190 0.72 LIPG (0.49) LIPGLPLALOX5TYRMEN1
SCHEMBL16615302 0.72 LIPG (0.49) LIPGLPLALOX5TYRMEN1
SCHEMBL4267973 0.72 LIPG (0.49) LIPGLPLALOX5TYRMEN1
SCHEMBL24297913 0.72 LPL (0.46) LIPGLPLALOX5TYRMEN1
SCHEMBL12890197 0.72 LIPG (0.38) LIPGLPLALOX5TYRMEN1
SCHEMBL16682948 0.72 LPL (0.47) LIPGLPLTYR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2492988-A1 ORGANIC ELECTROLUMINESCENT ELEMENT Sumitomo Chemical Company, Limited (JP) 2012-08-29 — — EP disclosed
US-20070213503-A1 PI-CONJUGATED POLYMER RICOH COMPANY, LTD. (JP) 2007-09-13 — — US disclosed
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