SCHEMBL20070697

SCHEMBL20070697

CC1(C)OB(c2ccc3ccc4c(c3c2)c2cccc3c5ccccc5n4c32)OC1(C)C

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LPL P06858 7/20 0.40
LIPG Q9Y5X9 7/20 0.40
IRAK4 Q9NWZ3 1/20 0.39
PRMT5 O14744 1/20 0.34
WDR77 Q9BQA1 1/20 0.34
EGFR P00533 1/20 0.33
IDO1 P14902 1/20 0.31
TDO2 P48775 1/20 0.31
ROCK1 Q13464 1/20 0.31
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA9 Q16790 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
SCHEMBL20071424 0.92 LPL (0.40) LPLLIPGIRAK4PRMT5WDR77
SCHEMBL16209531 0.89 LIPG (0.43) LPLLIPGIRAK4PRMT5WDR77
SCHEMBL29946205 0.89 LIPG (0.43) LPLLIPGIRAK4PRMT5WDR77
SCHEMBL20071777 0.89 LPL (0.34) LPLLIPGIRAK4EGFR
SCHEMBL20070695 0.88 LPL (0.36) LPLLIPGIRAK4PRMT5WDR77
SCHEMBL20071787 0.88 LPL (0.34) LPLLIPGIRAK4
SCHEMBL20071624 0.87 LPL (0.34) LPLLIPGIRAK4
SCHEMBL20071510 0.86 LPL (0.36) LPLLIPGIRAK4PRMT5WDR77
SCHEMBL20071458 0.84 PRMT5 (0.32) LPLLIPGIRAK4PRMT5WDR77
SCHEMBL17133801 0.84 LIPG (0.43) LPLLIPGIRAK4PRMT5WDR77

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-2018070836-A1 COMPOUND FOR ORGANIC ELECTRONIC DEVICE, ORGANIC ELECTRONIC DEVICE USING SAME AND ELECTRONIC APPARATUS THEREFOR 덕산네오룩스 주식회사 2018-04-19 WO disclosed