SCHEMBL21022646

SCHEMBL21022646

N#Cc1cc(-c2cccc(-n3c4ccccc4c4ccccc43)c2)cc(-n2c3ccccc3c3cc(-c4ccccc4)ccc32)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.41
KDM4E B2RXH2 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
PGR P06401 2/20 0.40
TSPO P30536 1/20 0.36
FAAH O00519 1/20 0.35
ALDH1A1 P00352 1/20 0.35
HSP90AA1 P07900 1/20 0.35
PKM P14618 1/20 0.35
HTT P42858 1/20 0.35
MGLL Q99685 1/20 0.35
ALDH1A3 P47895 1/20 0.35
CYP19A1 P11511 1/20 0.34
IRAK4 Q9NWZ3 1/20 0.34
HTR1A P08908 1/20 0.34
HTR7 P34969 1/20 0.34
MAP4K4 O95819 1/20 0.34
PTPN5 P54829 1/20 0.34
ADORA2A P29274 1/20 0.34
MCHR1 Q99705 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
SCHEMBL21984601 1.00 ATM (0.41) ATMKDM4EL3MBTL1PGRTSPO
SCHEMBL21022643 1.00 ATM (0.41) ATMKDM4EL3MBTL1PGRTSPO
SCHEMBL23058129 0.96 L3MBTL1 (0.46) ATMKDM4EL3MBTL1PGRTSPO
SCHEMBL21022644 0.96 KDM4E (0.41) ATMKDM4EL3MBTL1PGRTSPO
SCHEMBL21984914 0.96 KDM4E (0.41) ATMKDM4EL3MBTL1PGRTSPO
SCHEMBL21022650 0.96 KDM4E (0.41) ATMKDM4EL3MBTL1PGRTSPO
SCHEMBL21984909 0.95 ATM (0.41) ATMKDM4EL3MBTL1PGRTSPO
SCHEMBL21531849 0.94 ATM (0.41) ATMKDM4EL3MBTL1PGRTSPO
SCHEMBL15250659 0.94 L3MBTL1 (0.49) ATMKDM4EL3MBTL1PGRTSPO
SCHEMBL21531893 0.92 ATM (0.44) ATMKDM4EL3MBTL1TSPOFAAH

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-3490023-B1 COMPOSITION, THIN FILM INCLUDING THE COMPOSITION, AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE THIN FILM SAMSUNG ELECTRONICS CO LTD (KR) 2020-04-22 EP disclosed
EP-3490023-A1 COMPOSITION, THIN FILM INCLUDING THE COMPOSITION, AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE THIN FILM Samsung Electronics Co., Ltd. (KR) 2019-05-29 EP disclosed
US-20190157570-A1 COMPOSITION, THIN FILM INCLUDING THE COMPOSITION, AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE THIN FILM SAMSUNG ELECTRONICS CO LTD (KR) 2019-05-23 US disclosed