SCHEMBL28347406

SCHEMBL28347406

CCCCCCCOCc1ccc(C(C)CCCCOCCCCC(C)c2ccc(COCCCCCCC)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.39
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
PLA2G4B P0C869 1/20 0.37
ADRB2 P07550 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
THRB P10828 1/20 0.36
HTT P42858 1/20 0.36
MAPT P10636 1/20 0.36
NR5A1 Q13285 1/20 0.36
ADRB3 P13945 2/20 0.36
ADRB1 P08588 1/20 0.36
ALDH1A1 P00352 2/20 0.35
LMNA P02545 2/20 0.35
CYP3A4 P08684 2/20 0.35
USP2 O75604 1/20 0.35
MAPK1 P28482 1/20 0.35
CASP1 P29466 1/20 0.35
SMN1; SMN2 Q16637 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
SCHEMBL17868799 0.90 SLC2A1 (0.37) SLC2A1TDP1L3MBTL1PLA2G4BADRB2
SCHEMBL17027830 0.90 SLC2A1 (0.37) SLC2A1TDP1L3MBTL1PLA2G4BADRB2
SCHEMBL17027831 0.90 SLC2A1 (0.37) SLC2A1TDP1L3MBTL1PLA2G4BADRB2
SCHEMBL17027807 0.90 SLC2A1 (0.37) SLC2A1TDP1L3MBTL1PLA2G4BADRB2
SCHEMBL17027790 0.90 SLC2A1 (0.37) SLC2A1TDP1L3MBTL1PLA2G4BADRB2
SCHEMBL17868809 0.90 SLC2A1 (0.37) SLC2A1TDP1L3MBTL1PLA2G4BADRB2
SCHEMBL17868800 0.90 SLC2A1 (0.37) SLC2A1TDP1L3MBTL1PLA2G4BADRB2
SCHEMBL17027782 0.90 SLC2A1 (0.37) SLC2A1TDP1L3MBTL1PLA2G4BADRB2
SCHEMBL17027735 0.90 SLC2A1 (0.37) SLC2A1TDP1L3MBTL1PLA2G4BADRB2
SCHEMBL17027777 0.89 MEN1 (0.49) SLC2A1PLA2G4BADRB2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113906036-A Polycyclic aromatic compound 学校法人关西学院 2022-01-07 CN disclosed
CN-113784972-A Compound, material for organic device, composition for forming light-emitting layer, organic field-effect transistor, organic thin-film solar cell, organic electroluminescent element, display device, and lighting device 学校法人关西学院 2021-12-10 CN disclosed
CN-113412265-A Polycyclic aromatic compound 学校法人关西学院 2021-09-17 CN disclosed
CN-113227107-A Polycyclic aromatic compound 学校法人关西学院 2021-08-06 CN disclosed
CN-112997334-A Organic electroluminescent element using luminescent material of polycyclic aromatic compound 学校法人关西学院 2021-06-18 CN disclosed
CN-111936505-A Tertiary alkyl substituted polycyclic aromatic compound 学校法人关西学院 2020-11-13 CN disclosed
CN-111936504-A Cycloalkyl-substituted polycyclic aromatic compounds 学校法人关西学院 2020-11-13 CN disclosed
CN-110612304-A Polycyclic aromatic compound 学校法人关西学院 2019-12-24 CN disclosed