SCHEMBL31022147

SCHEMBL31022147

O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)c(-c3c(O)cc4oc(-c5ccc(O)c(O)c5)c(O)c(=O)c4c3O)c(O)c12

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AMY1A P0DUB6 3/20 0.81
PIM1 P11309 2/20 0.81
CD38 P28907 2/20 0.81
MEN1 O00255 8/20 0.70
KMT2A Q03164 8/20 0.70
KDM4E B2RXH2 7/20 0.70
CYP3A4 P08684 6/20 0.70
HSD17B10 Q99714 6/20 0.70
ALOX15 P16050 6/20 0.70
MAPT P10636 6/20 0.70
BCL9 O00512 6/20 0.70
CTNNB1 P35222 6/20 0.70
RECQL P46063 5/20 0.70
TP53 P04637 5/20 0.70
CYP2C9 P11712 5/20 0.70
LMNA P02545 4/20 0.70
APP P05067 4/20 0.70
SLCO2B1 O94956 4/20 0.70
ALDH1A1 P00352 4/20 0.70
HPGD P15428 4/20 0.70

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
SCHEMBL29998148 0.91 AMY1A (0.68) AMY1APIM1CD38MEN1KMT2A
Quercetagetin SCHEMBL29690479 0.90 AMY1A (1.00) AMY1APIM1CD38MEN1KMT2A
Quercetagetin SCHEMBL29608135 0.90 AMY1A (1.00) AMY1APIM1CD38MEN1KMT2A
Quercetagetin SCHEMBL554527 0.90 AMY1A (1.00) AMY1APIM1CD38MEN1KMT2A
SCHEMBL29569956 0.87 MEN1 (0.71) AMY1APIM1CD38MEN1KMT2A
SCHEMBL4879748 0.86 AMY1A (0.78) AMY1APIM1CD38MEN1KMT2A
SCHEMBL31305872 0.86 AMY1A (0.77) AMY1APIM1CD38MEN1KMT2A
SCHEMBL12557418 0.86 AMY1A (0.77) AMY1APIM1CD38MEN1KMT2A
SCHEMBL32691433 0.86 AMY1A (0.77) AMY1APIM1CD38MEN1KMT2A
SCHEMBL32691250 0.86 AMY1A (0.77) AMY1APIM1CD38MEN1KMT2A

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-118460398-A Application of lactobacillus plantarum CCFM1373 in relieving exposure toxicity of microplastic 江南大学 2024-08-09 CN disclosed
CN-118460399-A Application of lactobacillus plantarum CCFM1372 in relieving exposure toxicity of microplastic 江南大学 2024-08-09 CN disclosed