SCHEMBL30004183

SCHEMBL30004183

CC1=CC(=O)c2cc(Cl)c(Cl)cc2C1=O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.52
MAPT P10636 4/20 0.52
MAPK1 P28482 4/20 0.52
MEN1 O00255 3/20 0.52
BLM P54132 3/20 0.52
KMT2A Q03164 3/20 0.52
CYP1A2 P05177 3/20 0.52
TP53 P04637 2/20 0.52
CYP3A4 P08684 2/20 0.52
HSPD1 P10809 2/20 0.52
HPGD P15428 2/20 0.52
CDC25A P30304 2/20 0.52
CDC25B P30305 2/20 0.52
HSPE1 P61604 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
TST Q16762 2/20 0.52
LMNA P02545 2/20 0.52
USP2 O75604 2/20 0.52
GAA P10253 2/20 0.52
IDO1 P14902 2/20 0.52

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
SCHEMBL23271738 1.00 ALDH1A1 (0.52) ALDH1A1MAPTMAPK1MEN1BLM
SCHEMBL9627487 0.82 MAPT (0.56) ALDH1A1MAPTMAPK1MEN1BLM
SCHEMBL30002691 0.82 MAPT (0.56) ALDH1A1MAPTMAPK1MEN1BLM
SCHEMBL9627970 0.78 ALDH1A1 (0.57) ALDH1A1MAPTMAPK1MEN1BLM
SCHEMBL30003509 0.77 AURKA (0.41) ALDH1A1MAPTMAPK1MEN1BLM
SCHEMBL23271723 0.77 AURKA (0.41) ALDH1A1MAPTMAPK1MEN1BLM
SCHEMBL12822188 0.75 ALDH1A1 (0.54) ALDH1A1MAPTMAPK1MEN1BLM
SCHEMBL10446178 0.75 ALDH1A1 (0.64) ALDH1A1MAPTMAPK1MEN1BLM
SCHEMBL23271966 0.74 S100A4 (0.39) ALDH1A1MAPTMAPK1MEN1KMT2A
SCHEMBL18992102 0.74 KDM4E (0.38) ALDH1A1MAPTMAPK1MEN1KMT2A

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