SCHEMBL30475313

SCHEMBL30475313

O=C1c2ccccc2C(=O)c2c(Sc3ccccc3)cccc21

nearest known ligand 0.89

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.89
MAPK1 P28482 5/20 0.89
NSD2 O96028 2/20 0.89
KDM4E B2RXH2 2/20 0.89
ADORA2A P29274 2/20 0.57
ALDH1A1 P00352 7/20 0.54
MEN1 O00255 4/20 0.54
KMT2A Q03164 4/20 0.54
L3MBTL1 Q9Y468 5/20 0.49
EGFR P00533 3/20 0.44
TDP1 Q9NUW8 3/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
CDC25B P30305 2/20 0.44
LMNA P02545 2/20 0.44
PABPC1 P11940 1/20 0.44
RAB9A P51151 1/20 0.44
BCL2 P10415 3/20 0.44
MCL1 Q07820 2/20 0.44
PTPN1 P18031 1/20 0.44
CDC25A P30304 1/20 0.44

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
Anthraquinone SCHEMBL11411972 1.00 MAPT (0.89) MAPTMAPK1NSD2KDM4EADORA2A
SCHEMBL285567 1.00 MAPT (0.89) MAPTMAPK1NSD2KDM4EADORA2A
SCHEMBL4465042 0.96 MAPT (0.89) MAPTMAPK1NSD2KDM4EADORA2A
SCHEMBL3459973 0.94 MAPT (1.00) MAPTMAPK1NSD2KDM4EADORA2A
SCHEMBL29365916 0.94 MAPT (1.00) MAPTMAPK1NSD2KDM4EADORA2A
SCHEMBL22827087 0.91 MAPT (0.86) MAPTMAPK1NSD2KDM4EADORA2A
SCHEMBL11421896 0.88 MAPT (0.69) MAPTMAPK1NSD2KDM4EADORA2A
SCHEMBL11579534 0.88 MAPT (0.75) MAPTMAPK1NSD2KDM4EADORA2A
SCHEMBL14580985 0.86 MAPT (0.67) MAPTMAPK1NSD2KDM4EADORA2A
SCHEMBL9846494 0.86 MAPT (0.73) MAPTMAPK1NSD2KDM4EADORA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116333511-A Synthesis method of anthraquinone dye 江西扬帆新材料有限公司 2023-06-27 CN claimed
CN-116333511-B Synthesis method of anthraquinone dye 江西扬帆新材料有限公司 2023-12-12 CN disclosed
CN-116333511-A Synthesis method of anthraquinone dye 江西扬帆新材料有限公司 2023-06-27 CN disclosed