SCHEMBL21320456

SCHEMBL21320456

C1=Cc2c(n(-c3ccccc3)c3cccc(-c4ccc(-n5c6ccccc6c6ccc(-c7cccc(-c8cc(-c9ccc(-c%10ccccc%10)cc9)nc(-c9ccccc9)n8)c7)cc65)cc4)c23)CC1

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.31
▸ ALDH1A1 P00352 2/20 0.31
▸ MAPT P10636 2/20 0.31
▸ HPGD P15428 2/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ GLA P06280 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ L3MBTL1 Q9Y468 2/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31
▸ ATM Q13315 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
SCHEMBL21319865 0.97 KDM4E (0.31) KDM4EALDH1A1MAPTHPGDL3MBTL1
SCHEMBL21320073 0.91 ALDH1A1 (0.33) KDM4EALDH1A1MAPTHPGDMEN1
SCHEMBL21320518 0.91 KDM4E (0.32) KDM4EALDH1A1MAPTHPGDL3MBTL1
SCHEMBL21320389 0.87 GRM5 (0.34) MAPTL3MBTL1TDP1
SCHEMBL12065487 0.87 MAPT (0.37) KDM4EALDH1A1MAPTHPGDMEN1
SCHEMBL21319929 0.86 KDM4E (0.32) KDM4EALDH1A1MAPTHPGDMEN1
SCHEMBL21320229 0.86 KDM4E (0.32) KDM4EALDH1A1MAPTHPGDMEN1
SCHEMBL21320189 0.86 — —
SCHEMBL21320331 0.86 KDM4E (0.33) KDM4EL3MBTL1ATM
SCHEMBL17714728 0.86 MEN1 (0.38) KDM4EALDH1A1MAPTHPGDMEN1

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
EP-3015465-B1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME LG CHEMICAL LTD (KR) 2019-09-04 — — EP disclosed
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