SCHEMBL21769609

SCHEMBL21769609

CCc1nc2ccccc2n1-c1c2ccccc2c(-c2ccc([Si](c3ccccc3)(c3ccccc3)c3cc(-c4ccccc4)cc(-c4ccccc4)c3)cc2)c2ccccc12

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 2/20 0.40
MEN1 O00255 1/20 0.40
MAPT P10636 1/20 0.40
HPGD P15428 1/20 0.40
KMT2A Q03164 1/20 0.40
RECQL P46063 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
CYP1A2 P05177 1/20 0.34
PDE10A Q9Y233 1/20 0.34
BMI1 P35226 3/20 0.33
PPARG P37231 1/20 0.33
ADORA3 P0DMS8 1/20 0.33
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.33
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33

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
SCHEMBL26344936 0.88 KDM4E (0.48) KDM4EALDH1A1MEN1MAPTHPGD
SCHEMBL24600216 0.88 KDM4E (0.50) KDM4EALDH1A1MEN1MAPTHPGD
SCHEMBL26344922 0.86 KDM4E (0.52) KDM4EALDH1A1MEN1MAPTHPGD
SCHEMBL26345167 0.85 KDM4E (0.45) KDM4EALDH1A1MEN1MAPTHPGD
SCHEMBL26344940 0.85 MAPT (0.47) KDM4EALDH1A1MEN1MAPTHPGD
SCHEMBL21769456 0.84 KDM4E (0.41) KDM4EALDH1A1MEN1MAPTHPGD
SCHEMBL26345166 0.83 MAPT (0.43) KDM4EALDH1A1MEN1MAPTHPGD
SCHEMBL22955714 0.83 KDM4E (0.43) KDM4EALDH1A1MEN1MAPTHPGD
SCHEMBL22955794 0.82 KDM4E (0.44) KDM4EALDH1A1MEN1MAPTHPGD
SCHEMBL21392418 0.82 ALDH1A1 (0.46) KDM4EALDH1A1MEN1MAPTHPGD

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-2020040434-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME 주식회사 엘지화학 2020-02-27 WO disclosed