SCHEMBL10827151

SCHEMBL10827151

CS(=O)(=O)CCOC([O])=O

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 1/20 0.32
USP2 O75604 1/20 0.30
TSHR P16473 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
SCHEMBL4250054 0.82 ALDH1A1 (0.39) NLRP3USP2TSHR
SCHEMBL10669272 0.80 ALDH1A1 (0.46) NLRP3TSHR
SCHEMBL4201443 0.80 PLA2G2C (0.33) NLRP3USP2TSHR
SCHEMBL10841258 0.78 NLRP3 (0.31) NLRP3
SCHEMBL10669266 0.78 NLRP3 (0.31) NLRP3
SCHEMBL112027 0.78 LMNA (0.46) NLRP3TSHR
SCHEMBL635545 0.78 NLRP3 (0.31) NLRP3
SCHEMBL11316544 0.78 NLRP3 (0.36) NLRP3
SCHEMBL16449384 0.78 NLRP3 (0.31) NLRP3
SCHEMBL7156815 0.76 PLA2G2C (0.37) NLRP3USP2TSHR

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4604460-A ANTIBIOTICS, BACTERICIDES SHIONOGI & CO., LTD. (JP) 1986-08-05 US disclosed
US-4533730-A BACTERICIDES SHIONOGI & CO., LTD. (JP) 1985-08-06 US disclosed
US-4504659-A 1-Oxadethiacepham compounds SHIONOGI & CO., LTD. (JP) 1985-03-12 US disclosed
US-4478997-A 1-Oxadethiacepham compounds SHIONOGI & CO., LTD. (JP) 1984-10-23 US disclosed
US-4443598-A ANTIBIOTICS AND INTERMEDIATES SHIONOGI & CO., LTD. (JP) 1984-04-17 US disclosed
US-4366316-A FROM OXAZOLINOAZETIDINONE AND ACID SHIONOGI & CO., LTD. (JP) 1982-12-28 US disclosed