SCHEMBL28330106

SCHEMBL28330106

O=CNc1cc2ccccc2c(=O)[nH]1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC25B P30305 13/20 0.61
APAF1 O14727 6/20 0.61
KDM4E B2RXH2 5/20 0.61
CASP3 P42574 5/20 0.61
SENP8 Q96LD8 5/20 0.61
SENP7 Q9BQF6 5/20 0.61
SAE1 Q9UBE0 4/20 0.61
UBA2 Q9UBT2 4/20 0.61
THRB P10828 4/20 0.61
SENP6 Q9GZR1 4/20 0.61
ALDH1A1 P00352 4/20 0.61
HPGD P15428 4/20 0.61
MAPT P10636 3/20 0.61
RECQL P46063 2/20 0.61
UBE2I P63279 2/20 0.61
GALK1 P51570 1/20 0.61
SMAD3 P84022 1/20 0.61
ATG4B Q9Y4P1 1/20 0.61
CASP6 P55212 6/20 0.56
TDP2 O95551 5/20 0.56

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
SCHEMBL1749199 0.77 CYP2A6 (0.53) KDM4ECASP3SENP8SENP7SENP6
SCHEMBL28298129 0.75 CYP2A6 (0.52) KDM4ECASP3SENP8SENP7SENP6
SCHEMBL5262034 0.73 CYP2A6 (0.58) CDC25BAPAF1KDM4ECASP3SENP8
SCHEMBL150458 0.72 KDM4E (0.60) CDC25BAPAF1KDM4ECASP3SENP8
SCHEMBL29784203 0.72 KDM4E (0.60) CDC25BAPAF1KDM4ECASP3SENP8
SCHEMBL3968427 0.69 CDC25B (0.64) CDC25BAPAF1KDM4ECASP3SENP8
SCHEMBL6448568 0.68 KDM4E (0.60) CDC25BAPAF1KDM4ECASP3SENP8
SCHEMBL1687342 0.68 KDM4E (0.60) CDC25BAPAF1KDM4ECASP3SENP8
SCHEMBL1719778 0.68 LOXL2 (0.61) CDC25BAPAF1KDM4ECASP3SENP8
SCHEMBL1818129 0.68 KDM4E (0.60) CDC25BAPAF1KDM4ECASP3SENP8

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-107434782-B A kind of synthetic method of 4- oxyquinoline ketone derivatives and its application in antitumor research 重庆文理学院 2019-11-05 CN disclosed