SCHEMBL16170126

SCHEMBL16170126

c1ccc(-c2ccc(-c3ccc(-n4c5ccc(N(c6ccccc6)c6ccccc6)cc5c5c4c4ccccc4n5-c4ccc(-c5ccc(-c6ccccc6)cc5)cc4)cc3)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 3/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ ATM Q13315 1/20 0.39
▸ KMT2A Q03164 2/20 0.34
▸ IL1R1 P14778 1/20 0.34
▸ TSPO P30536 1/20 0.34
▸ HDAC4 P56524 1/20 0.34
▸ ALDH1A1 P00352 2/20 0.33
▸ MAPT P10636 2/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ EDNRA P25101 2/20 0.32
▸ EDNRB P24530 1/20 0.32
▸ NR3C1 P04150 1/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ CYP2D6 P10635 1/20 0.32
▸ CYP2C9 P11712 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ TDP1 Q9NUW8 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
SCHEMBL16170100 1.00 L3MBTL1 (0.39) L3MBTL1KDM4EATMKMT2AIL1R1
SCHEMBL16170127 0.99 L3MBTL1 (0.41) L3MBTL1KDM4EATMKMT2AIL1R1
SCHEMBL16170138 0.96 L3MBTL1 (0.36) L3MBTL1KDM4EATMKMT2AIL1R1
SCHEMBL16170102 0.93 L3MBTL1 (0.36) L3MBTL1KDM4EATMKMT2AIL1R1
SCHEMBL16170118 0.92 L3MBTL1 (0.45) L3MBTL1KDM4EATMKMT2AIL1R1
SCHEMBL16162885 0.91 KDM4E (0.47) L3MBTL1KDM4EATMKMT2AIL1R1
SCHEMBL16170139 0.90 L3MBTL1 (0.36) L3MBTL1KDM4EATMKMT2AIL1R1
SCHEMBL16170107 0.90 ESR1 (0.34) L3MBTL1KDM4EATMTSPOHDAC4
SCHEMBL19884882 0.90 L3MBTL1 (0.48) L3MBTL1KDM4EATMKMT2AIL1R1
SCHEMBL21699498 0.90 L3MBTL1 (0.48) L3MBTL1KDM4EATMKMT2AIL1R1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8987462-B2 Compound and organic light-emitting device comprising the same SAMSUNG DISPLAY CO., LTD. (KR) 2015-03-24 — — US disclosed
US-8987462-B2 Compound and organic light-emitting device comprising the same SAMSUNG DISPLAY CO., LTD. (KR) 2015-03-24 — — US disclosed
US-20140306197-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING THE SAME PUSAN NATIONAL UNIVERSITY INDUSTRY-UNIVERSITY COOPERATION FOUNDATION (KR) 2014-10-16 — — US disclosed
US-20140306197-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING THE SAME PUSAN NATIONAL UNIVERSITY INDUSTRY-UNIVERSITY COOPERATION FOUNDATION (KR) 2014-10-16 — — US disclosed
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