SCHEMBL23284396

SCHEMBL23284396

C1=CC(c2cccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5cccc(-c6ccccc6)c5)ccc43)c2)=CCC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.40
KDM4E B2RXH2 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
TSPO P30536 3/20 0.35
FAAH O00519 1/20 0.34
ALDH1A1 P00352 1/20 0.34
HSP90AA1 P07900 1/20 0.34
PKM P14618 1/20 0.34
HTT P42858 1/20 0.34
MGLL Q99685 1/20 0.34
HTR1A P08908 1/20 0.33
HTR7 P34969 1/20 0.33
WNK1 Q9H4A3 1/20 0.31
EDNRB P24530 1/20 0.31
EDNRA P25101 1/20 0.31
DNM1 Q05193 1/20 0.31
HDAC4 P56524 1/20 0.31
KMT2A Q03164 1/20 0.30
IL1R1 P14778 1/20 0.30
PTGER4 P35408 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
SCHEMBL22173059 0.99 ATM (0.39) ATMKDM4EL3MBTL1TSPOFAAH
SCHEMBL23228100 0.98 L3MBTL1 (0.43) ATMKDM4EL3MBTL1TSPOFAAH
SCHEMBL29307087 0.95 ATM (0.41) ATMKDM4EL3MBTL1TSPOFAAH
SCHEMBL22185982 0.95 ATM (0.41) ATMKDM4EL3MBTL1TSPOFAAH
SCHEMBL21698273 0.95 L3MBTL1 (0.43) ATMKDM4EL3MBTL1TSPOFAAH
SCHEMBL19723411 0.94 L3MBTL1 (0.42) ATMKDM4EL3MBTL1TSPOALDH1A1
SCHEMBL21583582 0.93 L3MBTL1 (0.47) ATMKDM4EL3MBTL1TSPOALDH1A1
SCHEMBL25719665 0.92 KDM4E (0.34) ATMKDM4EL3MBTL1
SCHEMBL23352234 0.92 L3MBTL1 (0.44) ATMKDM4EL3MBTL1TSPOALDH1A1
SCHEMBL22457078 0.91 L3MBTL1 (0.49) ATMKDM4EL3MBTL1TSPOALDH1A1

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-2022025515-A1 HETEROCYCLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME, AND COMPOSITION FOR ORGANIC LAYER OF ORGANIC LIGHT-EMITTING DEVICE 엘티소재주식회사 2022-02-03 WO disclosed
EP-3415585-B1 ORGANIC LIGHT-EMITTING ELEMENT LG CHEMICAL LTD (KR) 2021-04-28 EP disclosed