SCHEMBL13157274

SCHEMBL13157274

C(=C\c1ccc2c(c1)c1ccccc1n2-c1ccccc1)\c1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.60
▸ ATM Q13315 1/20 0.60
▸ L3MBTL1 Q9Y468 1/20 0.60
▸ RELA Q04206 1/20 0.42
▸ POLB P06746 2/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ GAA P10253 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ PKM P14618 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ BCHE P06276 1/20 0.39
▸ ACHE P22303 1/20 0.39
▸ HDAC3 O15379 1/20 0.39
▸ HDAC4 P56524 1/20 0.39
▸ HDAC1 Q13547 1/20 0.39
▸ HDAC7 Q8WUI4 1/20 0.39
▸ HDAC2 Q92769 1/20 0.39
▸ HDAC10 Q969S8 1/20 0.39
▸ HDAC11 Q96DB2 1/20 0.39
▸ HDAC8 Q9BY41 1/20 0.39

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
SCHEMBL10708650 1.00 KDM4E (0.60) KDM4EATML3MBTL1RELAPOLB
SCHEMBL10708645 1.00 KDM4E (0.60) KDM4EATML3MBTL1RELAPOLB
SCHEMBL27953870 0.97 KDM4E (0.64) KDM4EATML3MBTL1POLBMEN1
SCHEMBL8692442 0.95 KDM4E (0.50) KDM4EATML3MBTL1RELAPOLB
SCHEMBL2446031 0.94 KDM4E (0.56) KDM4EATML3MBTL1RELAPOLB
SCHEMBL17879400 0.92 L3MBTL1 (0.55) KDM4EATML3MBTL1POLBMEN1
SCHEMBL19253337 0.91 KDM4E (0.53) KDM4EATML3MBTL1POLBMEN1
SCHEMBL17011124 0.91 KDM4E (0.53) KDM4EATML3MBTL1POLBMEN1
SCHEMBL2956875 0.89 L3MBTL1 (0.55) KDM4EATML3MBTL1RELAPOLB
SCHEMBL2956869 0.89 L3MBTL1 (0.55) KDM4EATML3MBTL1RELAPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010115498-A1 ORGANIC ELECTROLUMINESCENCE DEVICE MERCK PATENT GMBH (DE) 2010-10-14 — — WO disclosed
WO-2010062065-A2 NOVEL NITROGEN-CONTAINING HETEROCYCLIC COMPOUND AND ORGANIC ELECTRONIC DEVICE USING THE SAME 주식회사 엘지화학 (KR) 2010-06-03 — — WO disclosed
Send feedback