SCHEMBL22303409

SCHEMBL22303409

Clc1c(Br)ccc2sc3ccccc3c12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 1/20 0.46
KDM4E B2RXH2 3/20 0.42
LOXL2 Q9Y4K0 1/20 0.42
MAPT P10636 6/20 0.41
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
MCL1 Q07820 2/20 0.41
DUSP3 P51452 2/20 0.41
BLM P54132 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
POLB P06746 1/20 0.41
PTPN5 P54829 1/20 0.41
PTPN11 Q06124 1/20 0.41
CTDSP1 Q9GZU7 1/20 0.41
HDAC1 Q13547 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
PTPN1 P18031 2/20 0.37
TNKS O95271 1/20 0.37
TNKS2 Q9H2K2 1/20 0.37

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
SCHEMBL2563740 0.81 GPR3 (0.50) GPR3KDM4ELOXL2MAPTMEN1
SCHEMBL30152091 0.81 GPR3 (0.50) GPR3KDM4ELOXL2MAPTMEN1
SCHEMBL23765077 0.78 GPR3 (0.46) GPR3KDM4ELOXL2MAPTMEN1
SCHEMBL1636538 0.77 GPR3 (0.68) GPR3KDM4ELOXL2MAPTMEN1
SCHEMBL29520053 0.76 GPR3 (0.54) GPR3KDM4ELOXL2MAPTMEN1
SCHEMBL7912643 0.76 GPR3 (0.54) GPR3KDM4ELOXL2MAPTMEN1
SCHEMBL29869583 0.76 GPR3 (0.54) GPR3KDM4ELOXL2MAPTMEN1
SCHEMBL24588613 0.76 GPR3 (0.54) GPR3KDM4ELOXL2MAPTMEN1
SCHEMBL22688468 0.74 GPR3 (0.46) GPR3KDM4EMAPTMEN1KMT2A
SCHEMBL16985163 0.73 GPR3 (0.62) GPR3KDM4ELOXL2MAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024071770-A1 COMPOUND FOR ORGANIC ELECTRICAL ELEMENT, ORGANIC ELECTRICAL ELEMENT USING SAME AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2024-04-04 WO disclosed
CN-115667248-A Novel compound and organic light emitting device comprising same 株式会社LG化学 2023-01-31 CN disclosed
EP-3764416-B1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING THE SAME, AND AN ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO LTD (KR) 2022-01-26 EP disclosed
EP-3764416-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING THE SAME, AND AN ELECTRONIC DEVICE THEREOF Duk San Neolux Co., Ltd. (KR) 2021-01-13 EP disclosed
WO-2020159332-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2020-08-06 WO disclosed