SCHEMBL29651964

SCHEMBL29651964

Brc1ccc2c(c1)Oc1cc(Br)ccc1C21c2ccccc2-c2ccccc21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 3/20 0.50
PDK2 Q15119 1/20 0.42
MEN1 O00255 3/20 0.39
MAPT P10636 3/20 0.39
KMT2A Q03164 3/20 0.39
FTO Q9C0B1 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
HTT P42858 2/20 0.39
HPGD P15428 1/20 0.39
CYP2C19 P33261 1/20 0.39
RECQL P46063 1/20 0.39
BLM P54132 1/20 0.39
SMAD3 P84022 1/20 0.39
PRMT1 Q99873 1/20 0.39
ACE2 Q9BYF1 1/20 0.39
OPRM1 P35372 1/20 0.35
OPRD1 P41143 1/20 0.35
LMNA P02545 2/20 0.35
PTPRC P08575 1/20 0.35
KDM4E B2RXH2 1/20 0.35

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
SCHEMBL21305014 0.97 AHR (0.52) AHRPDK2MEN1MAPTKMT2A
SCHEMBL30913037 0.97 AHR (0.52) AHRPDK2MEN1MAPTKMT2A
SCHEMBL22337016 0.91 AHR (0.42) AHRPDK2MEN1MAPTKMT2A
SCHEMBL15713471 0.90 AHR (0.47) AHRPDK2MEN1MAPTKMT2A
SCHEMBL29602520 0.90 AHR (0.47) AHRPDK2MEN1MAPTKMT2A
SCHEMBL15275878 0.89 AHR (0.59) AHRPDK2MEN1MAPTKMT2A
SCHEMBL20222314 0.88 AHR (0.46) AHRPDK2MEN1MAPTKMT2A
SCHEMBL23930743 0.87 AHR (0.42) AHRPDK2MEN1MAPTKMT2A
SCHEMBL30913036 0.87 AHR (0.42) AHRPDK2MEN1MAPTKMT2A
SCHEMBL29569989 0.86 AHR (0.52) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114539298-A Fused polycyclic compound and light emitting device including the same 三星显示有限公司 2022-05-27 CN disclosed