SCHEMBL29840591

SCHEMBL29840591

CS(=O)(=O)OCOS(C)(=O)=O.[Na]

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
USP2 O75604 2/20 0.53
TSHR P16473 2/20 0.53
KDM4E B2RXH2 2/20 0.53
ALDH1A1 P00352 2/20 0.53
LMNA P02545 1/20 0.53
MMP9 P14780 1/20 0.53
ALOX15 P16050 1/20 0.53
CYP3A4 P08684 1/20 0.33
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32

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
SCHEMBL783382 0.96 USP2 (0.56) USP2TSHRKDM4EALDH1A1LMNA
SCHEMBL840882 0.83 USP2 (0.50) USP2TSHRKDM4EALDH1A1LMNA
SCHEMBL12339103 0.82 USP2 (0.43) USP2TSHRKDM4EALDH1A1LMNA
SCHEMBL17036956 0.82 USP2 (0.43) USP2TSHRKDM4EALDH1A1LMNA
SCHEMBL5070659 0.80
SCHEMBL10656088 0.78
SCHEMBL14962984 0.78 USP2 (0.40) USP2TSHRKDM4EALDH1A1LMNA
SCHEMBL14962983 0.76 KDM4E (0.39) USP2TSHRKDM4EALDH1A1LMNA
SCHEMBL5873343 0.76
Ethane Dimethane Sulfonate SCHEMBL1336145 0.74 USP2 (0.75) USP2TSHRKDM4EALDH1A1LMNA

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-113292312-B Waterproof and moistureproof ceramic tile and preparation method thereof 深圳市汇格设计有限公司 2022-08-16 CN disclosed