SCHEMBL21716006

SCHEMBL21716006

C=CCC(=O)CNS(C)(=O)=O

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.32
PREP P48147 1/20 0.32
FAP Q12884 1/20 0.32
KMT2A Q03164 1/20 0.31
TGM2 P21980 1/20 0.30

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
SCHEMBL19919722 0.73 TDP1 (0.43) DPP4PREPFAPKMT2A
SCHEMBL397303 0.71 TSHR (0.43) KMT2A
SCHEMBL21715998 0.69 ALDH1A1 (0.37) KMT2A
SCHEMBL3250232 0.69 ALDH1A1 (0.32) DPP4PREPFAPKMT2A
SCHEMBL11973891 0.69 ALDH1A1 (0.35) KMT2A
Methyl Alcohol SCHEMBL27813915 0.69 ALDH1A1 (0.37)
SCHEMBL101280 0.68
SCHEMBL1797517 0.67
SCHEMBL2870199 0.67
SCHEMBL2840847 0.67

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
WO-2020031836-A1 POLYMERIZABLE IONIC LIQUID, POLYMER, CURABLE COMPOSITION, ELECTROCHEMICAL ELEMENT MATERIAL, AND ANTISTATIC MATERIAL セントラル硝子株式会社 2020-02-13 WO disclosed