SCHEMBL30003368

SCHEMBL30003368

COC1=CC(=O)c2cc(Cl)c(Cl)cc2C1=O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.56
CDC25A P30304 1/20 0.56
CDC25B P30305 1/20 0.56
TDP2 O95551 2/20 0.50
NSD2 O96028 2/20 0.50
GAPDH P04406 1/20 0.47
HKDC1 Q2TB90 3/20 0.47
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
USP2 O75604 1/20 0.43
TP53 P04637 1/20 0.43
CYP3A4 P08684 1/20 0.43
MAPT P10636 1/20 0.43
MAPK1 P28482 1/20 0.43
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
PTPN1 P18031 1/20 0.43
LCK P06239 2/20 0.38
ALOX5 P09917 4/20 0.37
PTGS2 P35354 1/20 0.37

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
SCHEMBL28379899 1.00 IDO1 (0.56) IDO1CDC25ACDC25BTDP2NSD2
SCHEMBL30004088 0.82 IDO1 (0.58) IDO1CDC25ACDC25BTDP2NSD2
SCHEMBL8582314 0.82 IDO1 (0.58) IDO1CDC25ACDC25BTDP2NSD2
SCHEMBL9628282 0.80 IDO1 (0.61) IDO1CDC25ACDC25BTDP2NSD2
SCHEMBL7807732 0.80 IDO1 (0.61) IDO1CDC25ACDC25BTDP2NSD2
SCHEMBL23271788 0.80 CDC25B (0.47) IDO1CDC25ACDC25BTDP2NSD2
SCHEMBL30003034 0.80 IDO1 (0.61) IDO1CDC25ACDC25BTDP2NSD2
SCHEMBL10865785 0.78 GAPDH (0.74) IDO1CDC25ACDC25BTDP2NSD2
SCHEMBL9627801 0.74 CDC25A (0.62) IDO1CDC25ACDC25BTDP2NSD2
SCHEMBL9628489 0.74 CDC25A (0.62) IDO1CDC25ACDC25BTDP2NSD2

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