SCHEMBL22140656

SCHEMBL22140656

O=c1c2c(O)cccc2c2cccc3c4ccccc4n1c23

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 4/20 0.60
MAPT P10636 3/20 0.60
HTT P42858 2/20 0.60
HPGD P15428 2/20 0.60
KDM4E B2RXH2 2/20 0.60
MEN1 O00255 2/20 0.60
KMT2A Q03164 2/20 0.60
ALDH1A1 P00352 1/20 0.60
MAOA P21397 2/20 0.40
PTPN1 P18031 2/20 0.39
APP P05067 1/20 0.38
THRB P10828 1/20 0.38
ALOX15 P16050 1/20 0.38
TSHR P16473 1/20 0.38
CASP1 P29466 1/20 0.38
SNCA P37840 1/20 0.38
RECQL P46063 1/20 0.38
HSD17B10 Q99714 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
DUSP3 P51452 1/20 0.38

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
SCHEMBL22140657 0.89 MAPT (0.59) POLBMAPTHTTHPGDKDM4E
SCHEMBL22140773 0.82 MAPT (0.51) POLBMAPTHTTHPGDKDM4E
SCHEMBL22140795 0.82 MAPT (0.51) POLBMAPTHTTHPGDKDM4E
SCHEMBL12181279 0.78 KMT2A (0.62) POLBMAPTHTTHPGDKDM4E
SCHEMBL29709994 0.78 POLB (0.53) POLBMAPTHTTHPGDKDM4E
SCHEMBL13442504 0.77 POLB (0.60) POLBMAPTHTTHPGDKDM4E
SCHEMBL22140751 0.76 PTPN1 (0.54) POLBMAPTHTTHPGDKDM4E
SCHEMBL12324448 0.75 KDM4E (0.58) POLBMAPTHTTHPGDKDM4E
SCHEMBL16260462 0.75 KMT2A (0.58) POLBMAPTHTTHPGDKDM4E
SCHEMBL22140800 0.74 MEN1 (0.57) POLBMAPTHTTHPGDKDM4E

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
WO-2020127165-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2020-06-25 WO disclosed