SCHEMBL30002691

SCHEMBL30002691

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

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.56
ALDH1A1 P00352 4/20 0.56
MEN1 O00255 4/20 0.56
KMT2A Q03164 4/20 0.56
MAPK1 P28482 3/20 0.56
BLM P54132 3/20 0.56
USP2 O75604 3/20 0.56
TP53 P04637 2/20 0.56
CYP1A2 P05177 2/20 0.56
CYP3A4 P08684 2/20 0.56
HSPD1 P10809 2/20 0.56
HPGD P15428 2/20 0.56
CDC25A P30304 2/20 0.56
CDC25B P30305 2/20 0.56
HSPE1 P61604 2/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
TST Q16762 2/20 0.56
LMNA P02545 2/20 0.56
GAA P10253 2/20 0.56
IDO1 P14902 2/20 0.56

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
SCHEMBL9627487 1.00 MAPT (0.56) MAPTALDH1A1MEN1KMT2AMAPK1
SCHEMBL23271738 0.82 ALDH1A1 (0.52) MAPTALDH1A1MEN1KMT2AMAPK1
SCHEMBL30004183 0.82 ALDH1A1 (0.52) MAPTALDH1A1MEN1KMT2AMAPK1
SCHEMBL12822188 0.79 ALDH1A1 (0.54) MAPTALDH1A1MEN1KMT2AMAPK1
SCHEMBL10446178 0.79 ALDH1A1 (0.64) MAPTALDH1A1MEN1KMT2AMAPK1
SCHEMBL8993580 0.77 XIAP (0.39) MAPTALDH1A1MEN1KMT2AMAPK1
SCHEMBL30003056 0.77 PADI1 (0.39) MAPTALDH1A1MEN1KMT2AMAPK1
SCHEMBL23271866 0.77 PADI1 (0.39) MAPTALDH1A1MEN1KMT2AMAPK1
SCHEMBL9628367 0.77 AURKA (0.39) MAPTALDH1A1MEN1KMT2AMAPK1
SCHEMBL30002673 0.77 XIAP (0.39) MAPTALDH1A1MEN1KMT2AMAPK1

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