SCHEMBL21364086

SCHEMBL21364086

Nc1ccc2c(c1)C1(c3cc(N)ccc3-2)c2cc(-n3c4ccccc4c4ccccc43)ccc2-c2ccc(-n3c4ccccc4c4ccccc43)cc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.42
ATM Q13315 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
ALDH1A1 P00352 6/20 0.39
MAPT P10636 5/20 0.39
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
HPGD P15428 4/20 0.39
HTT P42858 3/20 0.39
MAPK1 P28482 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
HBB P68871 1/20 0.39
HSD17B10 Q99714 1/20 0.39
PDK2 Q15119 2/20 0.38
LMNA P02545 5/20 0.36
SMN1; SMN2 Q16637 5/20 0.36
NPSR1 Q6W5P4 2/20 0.36
OPRK1 P41145 1/20 0.34
CHEK1 O14757 1/20 0.34
PRKD3 O94806 1/20 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
SCHEMBL601646 0.91 KDM4E (0.50) KDM4EATML3MBTL1ALDH1A1PDK2
SCHEMBL30293940 0.91 KDM4E (0.50) KDM4EATML3MBTL1ALDH1A1PDK2
SCHEMBL24725888 0.88 ALDH1A1 (0.40) KDM4EATML3MBTL1ALDH1A1MAPT
SCHEMBL21008867 0.88 KDM4E (0.44) KDM4EATML3MBTL1PDK2POLB
SCHEMBL30077228 0.86 KDM4E (0.46) KDM4EATML3MBTL1MAPTMEN1
SCHEMBL12292088 0.86 KDM4E (0.46) KDM4EATML3MBTL1MAPTMEN1
SCHEMBL29664894 0.86 KDM4E (0.46) KDM4EATML3MBTL1MAPTMEN1
SCHEMBL12171156 0.86 KDM4E (0.46) KDM4EATML3MBTL1MAPTMEN1
SCHEMBL390193 0.86 KDM4E (0.46) KDM4EATML3MBTL1MAPTMEN1
SCHEMBL17854687 0.85 KDM4E (0.42) KDM4EATML3MBTL1MAPTMEN1

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-20190284334-A1 POLY (SPIROBIFLUORENE) AND ORGANIC ELECTROLUMINESCENT DEVICE CHANGCHUN INSTITUTE OF APPLIED CHEMISTRY CHINESE ACADEMY OF SCIENCES (CN) 2019-09-19 US disclosed