SCHEMBL21385099

SCHEMBL21385099

CC1(C)OB(c2ccc(-c3ccc(-c4ccc5c(c4)Oc4cccc6ccnc-5c46)cc3)cc2)OC1(C)C

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 9/20 0.48
LPL P06858 8/20 0.48
SNCA P37840 1/20 0.33
MAOA P21397 1/20 0.32
EGFR P00533 1/20 0.31
DGAT1 O75907 1/20 0.31
IRAK4 Q9NWZ3 1/20 0.31
PDGFRB P09619 1/20 0.31
KDR P35968 1/20 0.31
KDM4E B2RXH2 1/20 0.30
MAPK1 P28482 1/20 0.30
ATM Q13315 1/20 0.30
F11 P03951 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
SCHEMBL21385123 0.91 LPL (0.38) LIPGLPLMAOAEGFRIRAK4
SCHEMBL21383190 0.79 MAOA (0.37) MAOAKDM4EMAPK1ATM
SCHEMBL17776257 0.74 KDM4E (0.51) LIPGLPLEGFRIRAK4KDM4E
SCHEMBL25223314 0.73 LIPG (0.61) LIPGLPLSNCAMAPK1ATM
SCHEMBL21382887 0.72 LIPG (0.39) LIPGLPLEGFRDGAT1PDGFRB
SCHEMBL21383216 0.71 AHR (0.41) MAOAEGFRKDM4EMAPK1ATM
SCHEMBL16558521 0.71 LIPG (0.39) LIPGLPLEGFRKDM4EMAPK1
SCHEMBL1827474 0.70 LIPG (0.54) LIPGLPLSNCADGAT1KDM4E
SCHEMBL21382869 0.70 LIPG (0.38) LIPGLPLEGFRDGAT1IRAK4
SCHEMBL25481886 0.70 MAOA (0.46) MAOAKDM4EMAPK1ATM

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-2019182360-A1 COMPOUND, ORGANIC LIGHT-EMITTING DEVICE AND DISPLAY DEVICE 에스케이머티리얼즈 주식회사 2019-09-26 WO disclosed