SCHEMBL31490474

SCHEMBL31490474

O=S(=O)(O)c1cccc2cccc(-c3ccccc3)c12

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 2/20 0.55
FABP4 P15090 1/20 0.55
CCNA2 P20248 1/20 0.55
CDK2 P24941 1/20 0.55
MAPK14 Q16539 1/20 0.55
NR4A1 P22736 1/20 0.54
CHAT P28329 1/20 0.44
SNCA P37840 1/20 0.44
ALDH1A1 P00352 3/20 0.41
CES2 O00748 1/20 0.41
BCHE P06276 1/20 0.41
CES1 P23141 1/20 0.41
MCL1 Q07820 1/20 0.41
CASP1 P29466 2/20 0.40
CYP3A4 P08684 1/20 0.40
PABPC1 P11940 1/20 0.40
DNMT1 P26358 1/20 0.40
CASP7 P55210 1/20 0.40
HSD17B10 Q99714 2/20 0.39
TSHR P16473 2/20 0.39

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
SCHEMBL11158822 1.00 TTR (0.55) TTRFABP4CCNA2CDK2MAPK14
SCHEMBL1668346 0.82 TTR (0.49) TTRFABP4CCNA2CDK2MAPK14
SCHEMBL22793869 0.81 HTR6 (0.46) ALDH1A1CES2BCHECES1MCL1
SCHEMBL232659 0.81 CASP1 (0.47) TTRFABP4CCNA2CDK2MAPK14
SCHEMBL29743050 0.81 CASP1 (0.47) TTRFABP4CCNA2CDK2MAPK14
SCHEMBL1742117 0.80 TTR (0.59) TTRFABP4CCNA2CDK2MAPK14
SCHEMBL392931 0.79 TSHR (0.41) TTRFABP4CCNA2CDK2MAPK14
SCHEMBL30166530 0.79 TSHR (0.41) TTRFABP4CCNA2CDK2MAPK14
Lithium SCHEMBL3173875 0.79 CASP1 (0.46) TTRFABP4CCNA2CDK2MAPK14
SCHEMBL28934633 0.79 CASP1 (0.46) TTRFABP4CCNA2CDK2MAPK14

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-119405066-A Preparation method of pea protein-containing compound 安徽农业大学 2025-02-11 CN disclosed