SCHEMBL12433926

SCHEMBL12433926

c1ccc(-c2cc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3ccc4c(-c5ccccc5)cc(-c5ccc(-n6c7ccccc7c7ccccc76)cc5)c5ccc2c3c45)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.55
KDM4E B2RXH2 3/20 0.55
ATM Q13315 1/20 0.55
HSD17B10 Q99714 2/20 0.41
HDAC4 P56524 1/20 0.41
KMT2A Q03164 4/20 0.39
IL1R1 P14778 1/20 0.39
ALDH1A1 P00352 5/20 0.38
MAPT P10636 3/20 0.38
MEN1 O00255 3/20 0.38
HTT P42858 2/20 0.38
MAPK14 Q16539 1/20 0.36
HPGD P15428 3/20 0.36
PTPN1 P18031 2/20 0.36
MAPK1 P28482 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
MPI P34949 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
POLB P06746 1/20 0.34
TSHR P16473 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
SCHEMBL29500555 0.97 L3MBTL1 (0.53) L3MBTL1KDM4EATMHSD17B10HDAC4
SCHEMBL9920639 0.94 L3MBTL1 (0.49) L3MBTL1KDM4EATMHSD17B10HDAC4
SCHEMBL17263982 0.93 L3MBTL1 (0.47) L3MBTL1KDM4EATMHSD17B10HDAC4
SCHEMBL9920980 0.91 KDM4E (0.46) L3MBTL1KDM4EATMHSD17B10HDAC4
SCHEMBL9920613 0.91 KDM4E (0.46) L3MBTL1KDM4EATMHSD17B10HDAC4
SCHEMBL15446737 0.91 KDM4E (0.46) L3MBTL1KDM4EATMHSD17B10HDAC4
SCHEMBL9920796 0.91 KDM4E (0.46) L3MBTL1KDM4EATMHSD17B10HDAC4
SCHEMBL15446745 0.90 KDM4E (0.45) L3MBTL1KDM4EATMHSD17B10HDAC4
SCHEMBL21943769 0.90 L3MBTL1 (0.63) L3MBTL1KDM4EATMHSD17B10HDAC4
SCHEMBL14429702 0.90 L3MBTL1 (0.63) L3MBTL1KDM4EATMHSD17B10HDAC4

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-7981523-B2 Aromatic amine derivative and organic electroluminescence device using the same IDEMITSU KOSAN CO., LTD. (JP) 2011-07-19 US disclosed
US-7981523-B2 Aromatic amine derivative and organic electroluminescence device using the same IDEMITSU KOSAN CO., LTD. (JP) 2011-07-19 US disclosed