SCHEMBL22065096

SCHEMBL22065096

N#Cc1cnc(-c2ccc(N3c4ccccc4C4(c5ccccc5Oc5ccccc54)c4ccccc43)cc2)c(C#N)c1

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PGR P06401 1/20 0.31
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
NPC1 O15118 1/20 0.30
MAPT P10636 1/20 0.30
TSHR P16473 1/20 0.30
RAB9A P51151 1/20 0.30
KMT2A Q03164 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL22065097 0.90 KDM4E (0.34) KDM4EMEN1NPC1MAPTTSHR
SCHEMBL22064967 0.89 PGR (0.37) PGRKDM4EMEN1MAPTKMT2A
SCHEMBL22065095 0.86 PGR (0.32) PGRKDM4EMAPTTSHRSMN1; SMN2
SCHEMBL22065081 0.85 USP8 (0.30)
SCHEMBL22064973 0.84 PGR (0.40) PGRNPC1TSHRRAB9A
SCHEMBL18392119 0.80 EGLN1 (0.31) KDM4EMEN1NPC1MAPTTSHR
SCHEMBL22065077 0.79 USP30 (0.35) KDM4EMAPTTSHR
SCHEMBL18393324 0.77 EGLN1 (0.32) KDM4EMEN1NPC1MAPTTSHR
SCHEMBL21396728 0.76 AR (0.32)
SCHEMBL22064946 0.75 PGR (0.32) PGR

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