SCHEMBL22907466

SCHEMBL22907466

N#Cc1ccc2c(c1)c1ccccc1n2-c1ccc(N(c2ccc(-n3c4ccccc4c4cc(C#N)ccc43)cc2)c2cccc([Si](c3ccccc3)(c3ccccc3)c3ccccc3)c2)cc1

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.35
ATM Q13315 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
RORC P51449 7/20 0.35
PTGER4 P35408 2/20 0.34
KDM1A O60341 1/20 0.33
USP14 P54578 3/20 0.32
PER2 O15055 1/20 0.32
CRY1 Q16526 1/20 0.32
CRY2 Q49AN0 1/20 0.32
TDP2 O95551 2/20 0.31
RARG P13631 1/20 0.31
G6PD P11413 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
SCHEMBL22907672 1.00 KDM4E (0.35) KDM4EATML3MBTL1RORCPTGER4
SCHEMBL22907470 0.94 RORC (0.34) KDM4EATML3MBTL1RORCPTGER4
SCHEMBL22907668 0.94 PTGER4 (0.35) KDM4EATML3MBTL1RORCPTGER4
SCHEMBL17463229 0.93 L3MBTL1 (0.38) KDM4EATML3MBTL1RORCPTGER4
SCHEMBL22907467 0.92 RORC (0.34) RORCPTGER4KDM1AUSP14PER2
SCHEMBL17463227 0.89 KDM4E (0.40) KDM4EATML3MBTL1RORCPTGER4
SCHEMBL12721976 0.88 RORC (0.40) KDM4EATML3MBTL1RORCPTGER4
SCHEMBL17463228 0.88 KDM4E (0.41) KDM4EATML3MBTL1RORCPTGER4
SCHEMBL22907670 0.88 KDM4E (0.46) KDM4EATML3MBTL1RORC
SCHEMBL25672913 0.86 KDM4E (0.46) KDM4EATML3MBTL1PTGER4

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-20210020854-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND POLYCYCLIC COMPOUND FOR ORGANIC ELECTROLUMINESCENCE DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2021-01-21 US disclosed