SCHEMBL21180679

SCHEMBL21180679

c1ccc(-n2c3ccccc3c3c(-c4cc5ccccc5c5cc6c(cc45)oc4ccccc46)cccc32)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SIRT2 Q8IXJ6 1/20 0.37
▸ SIRT1 Q96EB6 1/20 0.37
▸ KDM4E B2RXH2 4/20 0.37
▸ L3MBTL1 Q9Y468 2/20 0.37
▸ ATM Q13315 1/20 0.37
▸ ALDH1A1 P00352 6/20 0.37
▸ HPGD P15428 4/20 0.37
▸ TSHR P16473 2/20 0.37
▸ HSD17B10 Q99714 2/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ CASP1 P29466 1/20 0.37
▸ HIF1A Q16665 1/20 0.37
▸ AHR P35869 2/20 0.33
▸ KMT2A Q03164 4/20 0.32
▸ SMN1; SMN2 Q16637 4/20 0.32
▸ MEN1 O00255 3/20 0.32
▸ LMNA P02545 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ BRCA1 P38398 1/20 0.32
▸ DUSP3 P51452 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
SCHEMBL15946243 0.89 KDM4E (0.39) SIRT2SIRT1KDM4EL3MBTL1ATM
SCHEMBL15946239 0.89 KDM4E (0.39) SIRT2SIRT1KDM4EL3MBTL1ATM
SCHEMBL21180700 0.82 KDM4E (0.40) SIRT2SIRT1KDM4EL3MBTL1ATM
SCHEMBL21180582 0.82 KDM4E (0.40) SIRT2SIRT1KDM4EL3MBTL1ATM
SCHEMBL21180545 0.82 KDM4E (0.40) SIRT2SIRT1KDM4EL3MBTL1ATM
SCHEMBL21180578 0.82 KDM4E (0.40) SIRT2SIRT1KDM4EL3MBTL1ATM
SCHEMBL20706786 0.82 KDM4E (0.44) SIRT2SIRT1KDM4EL3MBTL1ATM
SCHEMBL20706805 0.80 KDM4E (0.50) KDM4EL3MBTL1ATMALDH1A1HPGD
SCHEMBL14725731 0.80 KDM4E (0.37) SIRT2SIRT1KDM4EL3MBTL1ATM
SCHEMBL23046453 0.80 KDM4E (0.44) SIRT2SIRT1KDM4EL3MBTL1ATM

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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