SCHEMBL28637720

SCHEMBL28637720

CN(CCS(C)(=O)=O)S(=O)(=O)CC(=O)O

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.36
MMP3 P08254 2/20 0.34
NLRP3 Q96P20 1/20 0.31

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
SCHEMBL28632556 0.79 POLB (0.39) POLBMMP3
SCHEMBL28632597 0.76 KDM4E (0.39) POLBMMP3
SCHEMBL4248401 0.71 POLB (0.48) POLB
SCHEMBL190142 0.67
SCHEMBL8593891 0.67 RCE1 (0.33) NLRP3
SCHEMBL10142958 0.66 CHRM1 (0.37) NLRP3
SCHEMBL17323652 0.66 POLB (0.42) POLB
SCHEMBL16081795 0.65 AKR1B1 (0.48)
SCHEMBL1858790 0.65
Hydrochloric Acid SCHEMBL1372491 0.65

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-113439081-A Pyridazinium compounds for use in methods of controlling unwanted plant growth 先正达农作物保护股份公司 2021-09-24 CN disclosed