SCHEMBL22065084

SCHEMBL22065084

N#Cc1cnc(-c2ccccc2N2c3ccccc3Oc3ccccc32)c(C#N)c1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.32
CNR2 P34972 2/20 0.32
EGLN2 Q96KS0 1/20 0.32
KDM4E B2RXH2 2/20 0.32
PTGER4 P35408 1/20 0.31
TRPA1 O75762 1/20 0.31
GRM5 P41594 1/20 0.31
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
KMT2A Q03164 1/20 0.31
HSD17B10 Q99714 1/20 0.31
IRAK4 Q9NWZ3 1/20 0.31

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
SCHEMBL22065081 0.90 USP8 (0.30)
SCHEMBL22064946 0.83 PGR (0.32) EGLN2PTGER4
SCHEMBL22065097 0.83 KDM4E (0.34) CNR1CNR2EGLN2KDM4EGRM5
SCHEMBL22064951 0.83 PGR (0.39) CNR1CNR2EGLN2KDM4EPTGER4
SCHEMBL22065083 0.81 NPSR1 (0.34) EGLN2
SCHEMBL21927204 0.81 ALDH1A1 (0.38) CNR2KDM4ETRPA1HPGDHSD17B10
SCHEMBL21927202 0.78 EGLN2 (0.40) EGLN2KDM4EGRM5HPGD
SCHEMBL21927332 0.77 LRRK2 (0.39) CYP1A2
SCHEMBL21927286 0.76 ALDH1A1 (0.36) CNR2KDM4ETRPA1HPGDHSD17B10
SCHEMBL21927287 0.76 EGLN2 (0.39) EGLN2KDM4EGRM5HPGD

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
US-20200185616-A1 ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DEVICE HAVING THE SAME LG DISPLAY CO., LTD (KR) 2020-06-11 US disclosed