SCHEMBL16613256

SCHEMBL16613256

c1ccc(-c2ccc(-c3nc(-n4c5ccccc5c5ccccc54)nc4c3ccn4-c3ccccc3)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 5/20 0.39
KDM4E B2RXH2 4/20 0.39
ATM Q13315 2/20 0.39
ALDH1A1 P00352 5/20 0.37
HPGD P15428 3/20 0.37
NPSR1 Q6W5P4 3/20 0.37
MAPT P10636 3/20 0.37
LMNA P02545 1/20 0.35
KMT2A Q03164 4/20 0.33
MAPK1 P28482 2/20 0.33
HTT P42858 2/20 0.33
RXFP1 Q9HBX9 2/20 0.32
HTR7 P34969 1/20 0.32
IL1R1 P14778 1/20 0.32
TP53 P04637 1/20 0.32
POLB P06746 2/20 0.32
TDP1 Q9NUW8 1/20 0.32
MEN1 O00255 2/20 0.32
HSD17B10 Q99714 1/20 0.32
DHODH Q02127 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
SCHEMBL16613289 0.97 KDM4E (0.41) L3MBTL1KDM4EATMALDH1A1HPGD
SCHEMBL16613313 0.93 KDM4E (0.37) L3MBTL1KDM4EATMALDH1A1HPGD
SCHEMBL16613637 0.92 L3MBTL1 (0.39) L3MBTL1KDM4EATMALDH1A1HPGD
SCHEMBL16613364 0.91 KDM4E (0.36) L3MBTL1KDM4EATMALDH1A1HPGD
SCHEMBL16613518 0.91 KDM4E (0.40) L3MBTL1KDM4EATMALDH1A1HPGD
SCHEMBL16613538 0.89 ALDH1A1 (0.32) L3MBTL1KDM4EATMALDH1A1HPGD
SCHEMBL16613234 0.89 KDM4E (0.33) L3MBTL1KDM4EATMALDH1A1HPGD
SCHEMBL16613273 0.88 KDM4E (0.34) L3MBTL1KDM4EATMALDH1A1KMT2A
SCHEMBL16613584 0.88 KDM4E (0.38) L3MBTL1KDM4EATMALDH1A1NPSR1
SCHEMBL16613519 0.88 KDM4E (0.38) L3MBTL1KDM4EATMALDH1A1NPSR1

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-2015047058-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME 주식회사 두산 2015-04-02 WO disclosed