SCHEMBL23728215

SCHEMBL23728215

Cc1cc2c3cc4c(cc3n3c5cccc6c7ccccc7n(c(c1)c23)c65)[nH]c1ccccc14

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 8/20 0.42
AHR P35869 2/20 0.41
KDM4E B2RXH2 2/20 0.37
MAPT P10636 2/20 0.37
ATM Q13315 1/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
NPC1 O15118 1/20 0.36
POLB P06746 1/20 0.36
ALDH1A1 P00352 2/20 0.34
HSD17B10 Q99714 2/20 0.34
GPR3 P46089 1/20 0.34
GABRP O00591 2/20 0.34
GABRD O14764 2/20 0.34
GABRA1 P14867 2/20 0.34
GABRB1 P18505 2/20 0.34
GABRG2 P18507 2/20 0.34
GABRB3 P28472 2/20 0.34
GABRA5 P31644 2/20 0.34
GABRA3 P34903 2/20 0.34

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
SCHEMBL23728209 0.90 AHR (0.50) KIF11AHRKDM4EMAPTATM
SCHEMBL24161464 0.86 AHR (0.52) KIF11AHRKDM4EMAPTATM
SCHEMBL23728211 0.85 AHR (0.41) KIF11AHRKDM4EMAPTATM
SCHEMBL23728401 0.84 AHR (0.55) KIF11AHRKDM4EMAPTATM
SCHEMBL25880160 0.83 ALKBH5 (0.44) KDM4EMAPTMEN1KMT2APOLB
SCHEMBL25880215 0.80 ALKBH5 (0.40) AHRKDM4EMAPTMEN1KMT2A
SCHEMBL25880217 0.80 ALKBH5 (0.40) KIF11KDM4EMAPTMEN1KMT2A
SCHEMBL16850413 0.79 AHR (0.53) KIF11AHRKDM4EMAPTATM
SCHEMBL25880167 0.78 GPR3 (0.41) KDM4EMAPTATMMEN1KMT2A
SCHEMBL20068639 0.78 AHR (0.49) KIF11AHRKDM4EMAPTATM

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-2021153931-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2021-08-05 WO disclosed