SCHEMBL30002572

SCHEMBL30002572

COC1=CC(=O)c2c(Cl)cccc2C1=O

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.59
CDC25A P30304 1/20 0.59
CDC25B P30305 1/20 0.59
TDP2 O95551 2/20 0.53
NSD2 O96028 2/20 0.53
PTPN1 P18031 1/20 0.50
APAF1 O14727 1/20 0.47
MITF O75030 1/20 0.47
ALDH1A1 P00352 1/20 0.47
LMNA P02545 1/20 0.47
MAPT P10636 1/20 0.47
HTT P42858 1/20 0.47
HKDC1 Q2TB90 2/20 0.46
PAX8 Q06710 1/20 0.45
ATG4B Q9Y4P1 1/20 0.45
GAPDH P04406 1/20 0.43
BACE1 P56817 1/20 0.41
AR P10275 1/20 0.41

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
SCHEMBL9628632 1.00 IDO1 (0.59) IDO1CDC25ACDC25BTDP2NSD2
SCHEMBL9713823 0.83 IDO1 (0.48) IDO1CDC25ACDC25BTDP2NSD2
SCHEMBL9713528 0.83 CDC25B (0.54) IDO1CDC25ACDC25BTDP2NSD2
SCHEMBL9713735 0.83 CDC25B (0.42) IDO1CDC25ACDC25BTDP2NSD2
SCHEMBL10394365 0.81 GAPDH (0.43) IDO1CDC25ACDC25BAPAF1MITF
SCHEMBL30002656 0.81 CDC25A (0.61) IDO1CDC25ACDC25BTDP2NSD2
SCHEMBL9627572 0.81 ALDH1A1 (0.71) IDO1CDC25ACDC25BTDP2NSD2
SCHEMBL8579585 0.81 CDC25A (0.61) IDO1CDC25ACDC25BTDP2NSD2
SCHEMBL30003153 0.81 ALDH1A1 (0.71) IDO1CDC25ACDC25BTDP2NSD2
SCHEMBL9713582 0.80 CDC25B (0.41) 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