SCHEMBL21180582

SCHEMBL21180582

c1ccc(-n2c3ccccc3c3ccc(-c4cc5ccccc5c5cc6oc7ccccc7c6cc45)cc32)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.40
▸ ATM Q13315 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ SIRT2 Q8IXJ6 1/20 0.37
▸ SIRT1 Q96EB6 1/20 0.37
▸ AHR P35869 2/20 0.33
▸ ALOX5 P09917 2/20 0.33
▸ MEN1 O00255 4/20 0.33
▸ KMT2A Q03164 4/20 0.33
▸ MAPT P10636 3/20 0.33
▸ ALDH1A1 P00352 3/20 0.33
▸ HPGD P15428 2/20 0.33
▸ PTGER4 P35408 1/20 0.32
▸ MAOA P21397 1/20 0.32
▸ SMN1; SMN2 Q16637 2/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ HCRTR1 O43613 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ POLB P06746 1/20 0.30

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
SCHEMBL21180545 1.00 KDM4E (0.40) KDM4EATML3MBTL1SIRT2SIRT1
SCHEMBL21180700 0.93 KDM4E (0.40) KDM4EATML3MBTL1SIRT2SIRT1
SCHEMBL21180578 0.93 KDM4E (0.40) KDM4EATML3MBTL1SIRT2SIRT1
SCHEMBL16472820 0.87 KDM4E (0.40) KDM4EATML3MBTL1SIRT2SIRT1
SCHEMBL14725730 0.87 KDM4E (0.40) KDM4EATML3MBTL1SIRT2SIRT1
SCHEMBL15912228 0.86 KDM4E (0.39) KDM4EATML3MBTL1SIRT2SIRT1
SCHEMBL16472793 0.86 KDM4E (0.39) KDM4EATML3MBTL1SIRT2SIRT1
SCHEMBL16472805 0.86 KDM4E (0.39) KDM4EATML3MBTL1SIRT2SIRT1
SCHEMBL16472817 0.86 KDM4E (0.39) KDM4EATML3MBTL1SIRT2SIRT1
SCHEMBL16472807 0.86 KDM4E (0.39) KDM4EATML3MBTL1SIRT2SIRT1

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-10361380-B2 Heterocyclic compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2019-07-23 — — US disclosed
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