SCHEMBL30003397

SCHEMBL30003397

NC1=Cc2ccccc2C(=O)C1=O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC25B P30305 2/20 0.52
CDC25A P30304 1/20 0.52
SLC2A1 P11166 1/20 0.48
NSD2 O96028 3/20 0.48
PTPN1 P18031 2/20 0.48
HKDC1 Q2TB90 1/20 0.48
MEN1 O00255 6/20 0.46
KMT2A Q03164 6/20 0.46
POLB P06746 6/20 0.46
PTPRC P08575 5/20 0.46
MAPT P10636 5/20 0.46
LMNA P02545 4/20 0.46
NPC1 O15118 4/20 0.46
RAB9A P51151 4/20 0.46
CES1 P23141 3/20 0.46
S100A4 P26447 3/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
HTT P42858 3/20 0.46
MAPK1 P28482 3/20 0.46
KDM4E B2RXH2 2/20 0.46

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
SCHEMBL6233550 1.00 CDC25B (0.52) CDC25BCDC25ASLC2A1NSD2PTPN1
SCHEMBL5969975 0.78
Hydrochloric Acid SCHEMBL5969933 0.75 PTPN1 (0.44) CDC25BCDC25ASLC2A1NSD2PTPN1
SCHEMBL227263 0.75 SLC2A1 (0.39) SLC2A1NSD2PTPN1HKDC1MEN1
SCHEMBL29809142 0.74 BACE1 (0.57) CDC25BCDC25APTPN1MEN1KMT2A
SCHEMBL10591042 0.74 SLC2A1 (0.38) SLC2A1NSD2PTPN1HKDC1MEN1
SCHEMBL10630648 0.74 SLC2A1 (0.38) SLC2A1NSD2PTPN1HKDC1MEN1
SCHEMBL3444897 0.73 CDC25B (0.57) CDC25BCDC25ANSD2PTPN1HKDC1
SCHEMBL8731780 0.73 CDC25B (0.52) CDC25BCDC25APTPN1MEN1KMT2A
SCHEMBL9353957 0.73 CDC25B (0.52) CDC25BCDC25APTPN1MEN1KMT2A

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-110891980-B Radical polymerization control agent and radical polymerization control method 川崎化成工业株式会社 2022-09-30 CN disclosed