SCHEMBL17072869

SCHEMBL17072869

CC1(C)OB(c2ccc3c(c2)Sc2ccccc2C=C3)OC1(C)C

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LPL P06858 13/20 0.45
LIPG Q9Y5X9 13/20 0.45
P4HB P07237 1/20 0.35
PRMT5 O14744 1/20 0.34
WDR77 Q9BQA1 1/20 0.34
ROCK1 Q13464 1/20 0.34
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
CA9 Q16790 2/20 0.33
IRAK4 Q9NWZ3 1/20 0.33
CA12 O43570 1/20 0.33
CA3 P07451 1/20 0.33
CA4 P22748 1/20 0.33
CA6 P23280 1/20 0.33
CA5A P35218 1/20 0.33
CA7 P43166 1/20 0.33
CA14 Q9ULX7 1/20 0.33
CA5B Q9Y2D0 1/20 0.33
F11 P03951 1/20 0.33

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
SCHEMBL17072799 0.91 LPL (0.45) LPLLIPGP4HBPRMT5WDR77
SCHEMBL21410492 0.89 LIPG (0.55) LPLLIPGP4HBCA1CA2
SCHEMBL21410373 0.83 LIPG (0.55) LPLLIPGP4HBCA1CA2
SCHEMBL203692 0.83 LIPG (0.51) LPLLIPGP4HBROCK1CA1
SCHEMBL20845043 0.81 LPL (0.39) LPLLIPGP4HBPRMT5WDR77
SCHEMBL21431382 0.81
SCHEMBL20845222 0.79 LPL (0.39) LPLLIPGP4HBPRMT5WDR77
SCHEMBL21410331 0.78 LIPG (0.39) LPLLIPGPRMT5WDR77
SCHEMBL2708201 0.77 LPL (0.47) LPLLIPGP4HBCA1CA2
SCHEMBL2707445 0.77 LPL (0.47) LPLLIPGP4HBCA1CA2

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
WO-2019190212-A1 COMPOUND, ORGANIC ELECTROLUMINESCENT DIODE AND DISPLAY DEVICE 에스케이머티리얼즈 주식회사 2019-10-03 WO disclosed
WO-2015133807-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME 주식회사 두산 2015-09-11 WO disclosed