SCHEMBL23930743

SCHEMBL23930743

Brc1ccc2c(c1)Oc1ccccc1C21c2ccccc2-c2cc3ccccc3cc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 3/20 0.42
PDK2 Q15119 5/20 0.38
CYP2A6 P11509 1/20 0.35
MEN1 O00255 3/20 0.32
MAPT P10636 3/20 0.32
KMT2A Q03164 3/20 0.32
FTO Q9C0B1 2/20 0.32
HTT P42858 2/20 0.32
SIRT1 Q96EB6 1/20 0.32
HPGD P15428 1/20 0.32
CYP2C19 P33261 1/20 0.32
RECQL P46063 1/20 0.32
BLM P54132 1/20 0.32
SMAD3 P84022 1/20 0.32
PRMT1 Q99873 1/20 0.32
ACE2 Q9BYF1 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
KDM4E B2RXH2 2/20 0.31
LMNA P02545 2/20 0.31
MAPK1 P28482 1/20 0.31

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
SCHEMBL19922303 0.93 AHR (0.42) AHRPDK2CYP2A6MEN1MAPT
SCHEMBL23930780 0.92 AHR (0.42) AHRPDK2CYP2A6MEN1MAPT
SCHEMBL22337016 0.90 AHR (0.42) AHRPDK2CYP2A6MEN1MAPT
SCHEMBL31195909 0.90 PDK2 (0.43) AHRPDK2CYP2A6MEN1MAPT
SCHEMBL19921848 0.90 PDK2 (0.43) AHRPDK2CYP2A6MEN1MAPT
SCHEMBL30913037 0.90 AHR (0.52) AHRPDK2CYP2A6MEN1MAPT
SCHEMBL21305014 0.90 AHR (0.52) AHRPDK2CYP2A6MEN1MAPT
SCHEMBL22651772 0.89 KDM4E (0.38) PDK2MEN1MAPTKMT2AFTO
SCHEMBL29602520 0.87 AHR (0.47) AHRPDK2MEN1MAPTKMT2A
SCHEMBL15713471 0.87 AHR (0.47) AHRPDK2MEN1MAPTKMT2A

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-2021215782-A1 ORGANIC LIGHT-EMITTING COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME 솔루스첨단소재 주식회사 (KR) 2021-10-28 WO disclosed
WO-2021215782-A1 ORGANIC LIGHT-EMITTING COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME 솔루스첨단소재 주식회사 (KR) 2021-10-28 WO disclosed