SCHEMBL30003153

SCHEMBL30003153

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

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.71
MAPT P10636 3/20 0.71
APAF1 O14727 1/20 0.71
MITF O75030 1/20 0.71
LMNA P02545 1/20 0.71
HTT P42858 1/20 0.71
IDO1 P14902 1/20 0.61
CDC25A P30304 1/20 0.61
CDC25B P30305 1/20 0.61
BACE1 P56817 2/20 0.60
TOP1 P11387 1/20 0.59
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
GAPDH P04406 2/20 0.54
EGFR P00533 1/20 0.53
PIM1 P11309 1/20 0.53
PTPN1 P18031 1/20 0.51
KDM4E B2RXH2 1/20 0.50
USP2 O75604 1/20 0.50
DUSP3 P51452 1/20 0.50

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
SCHEMBL9627572 1.00 ALDH1A1 (0.71) ALDH1A1MAPTAPAF1MITFLMNA
SCHEMBL8582559 0.86 GAPDH (0.69) ALDH1A1MAPTAPAF1MITFLMNA
SCHEMBL9627631 0.86 ALDH1A1 (0.61) ALDH1A1MAPTAPAF1MITFLMNA
SCHEMBL9627716 0.83 ALDH1A1 (1.00) ALDH1A1MAPTAPAF1MITFLMNA
SCHEMBL30003269 0.83 ALDH1A1 (1.00) ALDH1A1MAPTAPAF1MITFLMNA
SCHEMBL8579585 0.83 CDC25A (0.61) ALDH1A1MAPTAPAF1MITFLMNA
SCHEMBL30002656 0.83 CDC25A (0.61) ALDH1A1MAPTAPAF1MITFLMNA
SCHEMBL9864082 0.83 PTPN1 (0.61) ALDH1A1MAPTAPAF1MITFLMNA
SCHEMBL9177790 0.81 MAPT (0.69) ALDH1A1MAPTAPAF1MITFLMNA
SCHEMBL9629365 0.81 MAPT (0.69) ALDH1A1MAPTAPAF1MITFLMNA

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