SCHEMBL30003088

SCHEMBL30003088

O=C1C(Cl)=C(Cl)C(=O)c2cc(Cl)c(Cl)cc21

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.52
DNMT1 P26358 1/20 0.52
DNMT3L Q9UJW3 1/20 0.52
DNMT3A Q9Y6K1 1/20 0.52
CDC25B P30305 4/20 0.50
AHR P35869 3/20 0.47
MAPK1 P28482 2/20 0.47
CES1 P23141 3/20 0.47
CES2 O00748 2/20 0.47
BCHE P06276 2/20 0.47
ACHE P22303 2/20 0.47
KDM4E B2RXH2 2/20 0.47
MEN1 O00255 2/20 0.47
ALDH1A1 P00352 2/20 0.47
MAPT P10636 2/20 0.47
HPGD P15428 2/20 0.47
TSHR P16473 2/20 0.47
KMT2A Q03164 2/20 0.47
HSD17B10 Q99714 2/20 0.47
TP53 P04637 1/20 0.47

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
SCHEMBL23271824 1.00 IDO1 (0.52) IDO1DNMT1DNMT3LDNMT3ACDC25B
SCHEMBL4321232 0.87 AHR (0.53) IDO1DNMT1DNMT3LDNMT3ACDC25B
SCHEMBL30003014 0.82 NSD2 (0.56) IDO1DNMT1DNMT3LDNMT3ACDC25B
SCHEMBL23271807 0.82 NSD2 (0.56) IDO1DNMT1DNMT3LDNMT3ACDC25B
SCHEMBL30003301 0.77 IDO1 (0.48) IDO1DNMT1DNMT3LDNMT3ACDC25B
SCHEMBL1863215 0.77 IDO1 (0.48) IDO1DNMT1DNMT3LDNMT3ACDC25B
SCHEMBL30003579 0.77 MAOA (0.52) CDC25BAHRMAPK1CES1KDM4E
SCHEMBL23271704 0.77 MAOA (0.52) CDC25BAHRMAPK1CES1KDM4E
SCHEMBL14884476 0.75 NQO1 (0.42) AHRMAPK1CES1KDM4EMEN1
SCHEMBL29651770 0.75 MEN1 (0.63) IDO1DNMT1DNMT3LDNMT3ACDC25B

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