SCHEMBL13872016

SCHEMBL13872016

c1ccc(-c2c(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)cnc3c2ccc2c(-c4ccccc4)c(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cnc23)cc1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.46
KDM4E B2RXH2 2/20 0.46
ATM Q13315 1/20 0.46
KMT2A Q03164 3/20 0.40
NR1H2 P55055 3/20 0.38
NR1H3 Q13133 3/20 0.38
HDAC4 P56524 1/20 0.36
ALDH1A1 P00352 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
IL1R1 P14778 1/20 0.34
MEN1 O00255 2/20 0.33
MAPT P10636 1/20 0.33
HTT P42858 1/20 0.33
ENPP1 P22413 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
PTPN1 P18031 2/20 0.32
MAPK14 Q16539 1/20 0.32

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
SCHEMBL13872022 0.82 L3MBTL1 (0.43) L3MBTL1KDM4EATMHDAC4ALDH1A1
SCHEMBL14030752 0.82 NR1H2 (0.42) KMT2ANR1H2NR1H3MEN1ENPP1
SCHEMBL29416722 0.78 L3MBTL1 (0.68) L3MBTL1KDM4EATMKMT2AHDAC4
SCHEMBL12345498 0.78 L3MBTL1 (0.68) L3MBTL1KDM4EATMKMT2AHDAC4
SCHEMBL65355 0.78 L3MBTL1 (0.68) L3MBTL1KDM4EATMKMT2AHDAC4
SCHEMBL64830 0.78 L3MBTL1 (0.68) L3MBTL1KDM4EATMKMT2AHDAC4
SCHEMBL28356089 0.77 L3MBTL1 (0.57) L3MBTL1KDM4EATMKMT2AHDAC4
SCHEMBL12367175 0.77 KDM4E (0.45) L3MBTL1KDM4EATMHDAC4ALDH1A1
SCHEMBL13286813 0.77 L3MBTL1 (0.65) L3MBTL1KDM4EATMKMT2AHDAC4
SCHEMBL36248 0.77 L3MBTL1 (0.65) L3MBTL1KDM4EATMKMT2AHDAC4

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7517596-B2 Phenanthroline compound and light-emitting device CANON KABUSHIKI KAISHA (JP) 2009-04-14 US disclosed
US-7517596-B2 Phenanthroline compound and light-emitting device CANON KABUSHIKI KAISHA (JP) 2009-04-14 US disclosed