SCHEMBL31423866

SCHEMBL31423866

CC(=O)OCc1ncccc1OC(C)=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 3/20 0.50
CHRM4 P08173 3/20 0.50
CHRM5 P08912 3/20 0.50
CHRM1 P11229 3/20 0.50
CHRM3 P20309 3/20 0.50
KDM4E B2RXH2 3/20 0.46
TDP1 Q9NUW8 2/20 0.46
CYP3A4 P08684 1/20 0.46
ALOX12 P18054 1/20 0.46
ALDH1A1 P00352 3/20 0.43
PDE5A O76074 1/20 0.43
PTGS2 P35354 4/20 0.41
ESR1 P03372 1/20 0.41
ITGB3 P05106 1/20 0.41
ITGA2B P08514 1/20 0.41
HMGB1 P09429 1/20 0.41
HPGD P15428 1/20 0.41
TSHR P16473 1/20 0.41
GGT1 P19440 1/20 0.41
PTGS1 P23219 1/20 0.41

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
SCHEMBL4979353 1.00 CHRM2 (0.50) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL1687118 0.83 KDM4E (0.48) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL2082149 0.82 CHRM2 (0.46) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL4062858 0.80 ALDH1A1 (0.46) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL4982157 0.80 CHRM2 (0.61) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL31088058 0.80 ALDH1A1 (0.46) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL24107663 0.79 ALDH1A1 (0.44) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL8537744 0.79 ALDH1A1 (0.44) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL11002295 0.78 PTGS1 (0.47) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL16742916 0.78 PDE5A (0.44) CHRM2CHRM4CHRM5CHRM1CHRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119842309-A High-heat-conductivity anti-corrosion hydrophilic aluminum foil and preparation method thereof 江苏金天辰新材料有限公司 2025-04-18 CN claimed
CN-119842309-A High-heat-conductivity anti-corrosion hydrophilic aluminum foil and preparation method thereof 江苏金天辰新材料有限公司 2025-04-18 CN disclosed
CN-119842309-A High-heat-conductivity anti-corrosion hydrophilic aluminum foil and preparation method thereof 江苏金天辰新材料有限公司 2025-04-18 CN disclosed