SCHEMBL20172103

SCHEMBL20172103

Nc1cccc2c1c1ncccc1n2-c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.39
ATM Q13315 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
REN P00797 8/20 0.38
HSP90AA1 P07900 1/20 0.36
HSP90AB1 P08238 1/20 0.36
IDO1 P14902 1/20 0.36
PSMB5 P28074 1/20 0.36
PDE4A P27815 1/20 0.35
PDE4B Q07343 1/20 0.35
PDE4C Q08493 1/20 0.35
PDE4D Q08499 1/20 0.35
ADORA2A P29274 1/20 0.35
ADORA3 P0DMS8 1/20 0.34
PDE10A Q9Y233 1/20 0.34

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
SCHEMBL22373881 0.81 REN (0.44) KDM4EATML3MBTL1RENADORA2A
SCHEMBL17349299 0.81 KDM4E (0.39) KDM4EATML3MBTL1RENPDE10A
SCHEMBL12396572 0.81 KDM4E (0.52) KDM4EATML3MBTL1RENHSP90AA1
SCHEMBL20172102 0.79 HSP90AA1 (0.41) KDM4EATML3MBTL1RENHSP90AA1
SCHEMBL20172238 0.79 FEN1 (0.46) KDM4EATML3MBTL1RENPDE4A
SCHEMBL17349366 0.78 KDM4E (0.47) KDM4EATML3MBTL1RENPDE4A
SCHEMBL12396559 0.75 L3MBTL1 (0.61) KDM4EATML3MBTL1RENHSP90AA1
SCHEMBL18371367 0.75 L3MBTL1 (0.61) KDM4EATML3MBTL1
SCHEMBL26329984 0.75 L3MBTL1 (0.47) KDM4EATML3MBTL1RENHSP90AA1
SCHEMBL18958268 0.75 KDM4E (0.47) KDM4EATML3MBTL1PDE4APDE4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3339395-B1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO LTD (KR) 2019-10-02 EP disclosed
EP-3339395-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME Samsung Electronics Co., Ltd. (KR) 2018-06-27 EP disclosed
EP-2980182-B1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO LTD (KR) 2018-05-23 EP disclosed