SCHEMBL21676083

SCHEMBL21676083

c1ccc(-n2c3c4ccccc4ccc3c3ccc4c(c5ccccc5n4-c4cccc(-c5cccc6c5-c5cccc7cccc-6c57)c4)c32)cc1

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.34
ATM Q13315 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
KMT2A Q03164 1/20 0.31
PDE10A Q9Y233 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
SCHEMBL21676140 0.93 KDM4E (0.33) KDM4EATML3MBTL1KMT2APDE10A
SCHEMBL21676075 0.92 KDM4E (0.35) KDM4EATML3MBTL1KMT2APDE10A
SCHEMBL21676078 0.89 L3MBTL1 (0.35) KDM4EATML3MBTL1
SCHEMBL21676072 0.88 PDE6D (0.34) PDE10A
SCHEMBL21676087 0.86 L3MBTL1 (0.36) KDM4EATML3MBTL1PDE10A
SCHEMBL21676151 0.86 PDE6D (0.35) KDM4EATML3MBTL1
SCHEMBL21676067 0.86 PDE10A (0.32) KDM4EATML3MBTL1PDE10A
SCHEMBL21676062 0.85 ATM (0.34) KDM4EATML3MBTL1PDE10A
SCHEMBL21676133 0.84 KDM4E (0.35) KDM4EATML3MBTL1
SCHEMBL20321840 0.84 ALDH1A1 (0.31) L3MBTL1

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-2020026133-A1 POLYCYCLIC COMPOUND, ORGANIC ELECTROLUMINESCENCE DEVICE, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2020-02-06 WO disclosed