SCHEMBL22907470

SCHEMBL22907470

Cc1ccc2c(c1)c1cc(C)ccc1n2-c1ccc(N(c2ccc(-n3c4ccccc4c4cc(C#N)ccc43)cc2)c2cccc([Si](c3ccccc3)(c3ccccc3)c3ccccc3)c2)cc1

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RORC P51449 5/20 0.34
USP14 P54578 4/20 0.33
PTGER4 P35408 2/20 0.33
KDM1A O60341 2/20 0.32
PER2 O15055 1/20 0.32
CRY1 Q16526 1/20 0.32
CRY2 Q49AN0 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ATM Q13315 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
MAPT P10636 2/20 0.31
TP53 P04637 1/20 0.31
TDP2 O95551 1/20 0.30
APP P05067 1/20 0.30
CYP19A1 P11511 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
SCHEMBL22907466 0.94 KDM4E (0.35) RORCUSP14PTGER4KDM1APER2
SCHEMBL22907672 0.94 KDM4E (0.35) RORCUSP14PTGER4KDM1APER2
SCHEMBL22907471 0.91 KDM4E (0.38) RORCPTGER4KDM1AKDM4EATM
SCHEMBL22907467 0.89 RORC (0.34) RORCUSP14PTGER4KDM1APER2
SCHEMBL22907668 0.89 PTGER4 (0.35) RORCPTGER4KDM1AKDM4EATM
SCHEMBL22907468 0.88 APP (0.37) RORCKDM4EATML3MBTL1MAPT
SCHEMBL17463229 0.87 L3MBTL1 (0.38) RORCUSP14PTGER4PER2CRY1
SCHEMBL22907608 0.86 KDM4E (0.35) USP14PTGER4KDM4EATML3MBTL1
SCHEMBL13249700 0.85 RORC (0.35) RORCUSP14KDM4EL3MBTL1MAPT
SCHEMBL17463227 0.84 KDM4E (0.40) RORCUSP14PTGER4PER2CRY1

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