SCHEMBL30003107

SCHEMBL30003107

CC1=CC(=O)c2c(Cl)cccc2C1=O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.64
ALDH1A1 P00352 4/20 0.64
MEN1 O00255 3/20 0.64
MAPK1 P28482 3/20 0.64
BLM P54132 3/20 0.64
KMT2A Q03164 3/20 0.64
CYP1A2 P05177 3/20 0.64
KDM4E B2RXH2 3/20 0.64
RECQL P46063 3/20 0.64
TP53 P04637 2/20 0.64
CYP3A4 P08684 2/20 0.64
HSPD1 P10809 2/20 0.64
HPGD P15428 2/20 0.64
CDC25A P30304 2/20 0.64
CDC25B P30305 2/20 0.64
HSPE1 P61604 2/20 0.64
SMN1; SMN2 Q16637 2/20 0.64
TST Q16762 2/20 0.64
CYP1A1 P04798 2/20 0.64
MAP2K7 O14733 1/20 0.64

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
SCHEMBL23271685 1.00 MAPT (0.64) MAPTALDH1A1MEN1MAPK1BLM
SCHEMBL30003334 0.81 AURKA (0.53) MAPTALDH1A1MEN1MAPK1BLM
SCHEMBL9627478 0.81 AURKA (0.53) MAPTALDH1A1MEN1MAPK1BLM
SCHEMBL30002968 0.81 ALDH1A1 (0.68) MAPTALDH1A1MEN1MAPK1BLM
SCHEMBL5805855 0.81 ALDH1A1 (0.68) MAPTALDH1A1MEN1MAPK1BLM
SCHEMBL18992139 0.78 MAPT (0.53) MAPTALDH1A1MEN1MAPK1BLM
SCHEMBL4304091 0.78 ALDH1A1 (0.64) MAPTALDH1A1MEN1MAPK1BLM
Plumbagin SCHEMBL34186 0.78 MAPT (1.00) MAPTALDH1A1MEN1MAPK1BLM
SCHEMBL23271713 0.78 S100A4 (0.46) MAPTALDH1A1MEN1MAPK1BLM
SCHEMBL30003616 0.78 S100A4 (0.46) MAPTALDH1A1MEN1MAPK1BLM

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