SCHEMBL29246744

SCHEMBL29246744

CCCOc1cc(OCCC)c(C=O)cc1Cl

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CSNK2A1 P68400 2/20 0.45
ALDH1A1 P00352 3/20 0.40
KDM4E B2RXH2 2/20 0.40
TSHR P16473 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
HPGD P15428 1/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ERN1 O75460 3/20 0.39
PPOX P50336 2/20 0.39
MCOLN3 Q8TDD5 1/20 0.38
LMNA P02545 2/20 0.38
KMT2A Q03164 1/20 0.37
PDCD1 Q15116 1/20 0.37
CD274 Q9NZQ7 1/20 0.37
DPP4 P27487 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36

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
SCHEMBL29771742 1.00 CSNK2A1 (0.45) CSNK2A1ALDH1A1KDM4ETSHRTDP1
SCHEMBL29246740 0.92 SMN1; SMN2 (0.43) CSNK2A1ALDH1A1KDM4ETSHRTDP1
SCHEMBL29771757 0.92 SMN1; SMN2 (0.43) CSNK2A1ALDH1A1KDM4ETSHRTDP1
SCHEMBL29246742 0.90 THRB (0.45) ALDH1A1KDM4ETSHRTDP1HPGD
SCHEMBL30584236 0.90 THRB (0.45) ALDH1A1KDM4ETSHRTDP1HPGD
SCHEMBL29771746 0.86 LMNA (0.51) ALDH1A1KDM4ETSHRTDP1HPGD
SCHEMBL29246798 0.86 LMNA (0.51) ALDH1A1KDM4ETSHRTDP1HPGD
SCHEMBL19025124 0.85 DPP4 (0.44) CSNK2A1ALDH1A1ERN1PPOXDPP4
SCHEMBL28648665 0.85 LMNA (0.48) CSNK2A1ALDH1A1KDM4ETSHRTDP1
SCHEMBL23239707 0.83 L3MBTL1 (0.41) ALDH1A1KDM4ETSHRTDP1HPGD

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114853652-B Sulfonium salt compound, preparation method and application thereof, and cationic UV (ultraviolet) curing adhesive 韦尔通科技股份有限公司 2023-08-29 CN disclosed
CN-114853652-A Sulfonium salt compound, preparation method and application thereof, and cationic UV (ultraviolet) curing adhesive 韦尔通(厦门)科技股份有限公司 2022-08-05 CN disclosed