SCHEMBL20180253

SCHEMBL20180253

CC1(C)OB(c2cccc(-n3ccc4c5ccccc5ccc43)c2)OC1(C)C

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LPL P06858 4/20 0.41
LIPG Q9Y5X9 4/20 0.41
IRAK4 Q9NWZ3 1/20 0.38
PRMT5 O14744 1/20 0.30
WDR77 Q9BQA1 1/20 0.30
BACE1 P56817 1/20 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
SCHEMBL20180310 0.84 LPL (0.42) LPLLIPGIRAK4PRMT5WDR77
SCHEMBL19119810 0.84 LPL (0.43) LPLLIPGIRAK4
SCHEMBL20180416 0.81 LPL (0.44) LPLLIPGIRAK4PRMT5WDR77
SCHEMBL18019421 0.81 LPL (0.43) LPLLIPGIRAK4PRMT5WDR77
SCHEMBL20180139 0.78 LIPG (0.49) LPLLIPGIRAK4
SCHEMBL29445688 0.77 KDM4E (0.44) LPLLIPGIRAK4PRMT5WDR77
SCHEMBL355715 0.77 KDM4E (0.44) LPLLIPGIRAK4PRMT5WDR77
SCHEMBL19031798 0.76 LIPG (0.45) LPLLIPGIRAK4
SCHEMBL20180524 0.75 MEN1 (0.43)
SCHEMBL15533400 0.75 LPL (0.46) LPLLIPGIRAK4

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-2018093107-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME 주식회사 두산 2018-05-24 WO disclosed