SCHEMBL28338917

SCHEMBL28338917

[Ir].c1ccc(-c2nc3ccccc3n2-c2ccccc2)cc1.c1ccc(-c2nc3ccccc3n2-c2ccccc2)cc1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 3/20 0.76
ESR1 P03372 2/20 0.76
MAPK1 P28482 1/20 0.62
HTT P42858 1/20 0.62
GRIA1 P42261 1/20 0.59
CACNG8 Q8WXS5 1/20 0.59
CACNG2 Q9Y698 1/20 0.59
RECQL P46063 1/20 0.56
PRKACA P17612 1/20 0.55
RPS6KB1 P23443 1/20 0.55
GSK3B P49841 1/20 0.55
ROCK1 Q13464 1/20 0.55
PTGS2 P35354 1/20 0.52
HDAC1 Q13547 1/20 0.52
HDAC8 Q9BY41 1/20 0.52
HDAC6 Q9UBN7 1/20 0.52
KDM4E B2RXH2 3/20 0.51
ALDH1A1 P00352 2/20 0.51
HPGD P15428 2/20 0.51
PDE6D O43924 1/20 0.51

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
SCHEMBL27860194 1.00 ESR2 (0.76) ESR2ESR1MAPK1HTTGRIA1
SCHEMBL541157 0.98 ESR2 (0.78) ESR2ESR1MAPK1HTTGRIA1
SCHEMBL29406589 0.96 ESR2 (0.76) ESR2ESR1MAPK1HTTGRIA1
SCHEMBL30282233 0.96 ESR2 (0.76) ESR2ESR1MAPK1HTTGRIA1
SCHEMBL14160911 0.95 ESR1 (0.73) ESR2ESR1MAPK1HTTGRIA1
SCHEMBL804992 0.94 ESR2 (0.73) ESR2ESR1MAPK1HTTGRIA1
SCHEMBL10041513 0.93 ESR2 (0.71) ESR2ESR1MAPK1HTTGRIA1
SCHEMBL16692234 0.93 ESR2 (0.71) ESR2ESR1MAPK1HTTGRIA1
SCHEMBL28113037 0.91 ESR2 (0.74) ESR2ESR1MAPK1HTTGRIA1
SCHEMBL22618152 0.90 ESR1 (0.68) ESR2ESR1MAPK1HTTGRIA1

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 63 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112534602-B Mixture, organic electroluminescent element, and electronic device 出光兴产株式会社 2024-05-10 CN disclosed
CN-111712493-B Compound and organic electroluminescent element using same 出光兴产株式会社 2024-05-07 CN disclosed
CN-117897374-A Compound, material for organic electroluminescent element, and electronic device 出光兴产株式会社 2024-04-16 CN disclosed
CN-117751100-A Compound, material for organic electroluminescent element, and electronic device 出光兴产株式会社 2024-03-22 CN disclosed
CN-117642045-A Organic electroluminescent device 长春海谱润斯科技股份有限公司 2024-03-01 CN disclosed
CN-117545736-A Compound, material for organic electroluminescent element, and electronic device 出光兴产株式会社 2024-02-09 CN disclosed
CN-117480152-A Compound, material for organic electroluminescent element, and electronic device 出光兴产株式会社 2024-01-30 CN disclosed
CN-111655674-B Compound and organic electroluminescent element using the same 出光兴产株式会社 2024-01-23 CN disclosed
CN-117425641-A Compound, material for organic electroluminescent element, and electronic device 出光兴产株式会社 2024-01-19 CN disclosed
CN-117377650-A Compound, material for organic electroluminescent element, and electronic device 出光兴产株式会社 2024-01-09 CN disclosed
CN-113227083-A Compound, material for organic electroluminescent element, and electronic device 出光兴产株式会社 2021-08-06 CN disclosed
CN-113166038-A Compound, material for organic electroluminescent element, and electronic device 出光兴产株式会社 2021-07-23 CN disclosed
CN-107848950-B Compound, material for organic electroluminescent element, and electronic device 出光兴产株式会社 2021-04-02 CN disclosed
CN-112534602-A Mixture, organic electroluminescent element, and electronic device 出光兴产株式会社 2021-03-19 CN disclosed
CN-112334456-A Compound, material for organic electroluminescent element, and electronic device 出光兴产株式会社 2021-02-05 CN disclosed
CN-112119066-A Compound, material for organic electroluminescent element, and electronic device 出光兴产株式会社 2020-12-22 CN disclosed
CN-111902409-A Compound, material for organic electroluminescent element, and electronic device 出光兴产株式会社 2020-11-06 CN disclosed
CN-111868046-A Compound, material for organic electroluminescent element, and electronic device 出光兴产株式会社 2020-10-30 CN disclosed
CN-111655674-A Compound and organic electroluminescent element using the same 出光兴产株式会社 2020-09-11 CN disclosed
CN-106083835-B Heterocyclic compound, light-emitting element, light-emitting device, electronic device, and lighting device 株式会社半导体能源研究所 2020-01-07 CN disclosed