SCHEMBL16449384

SCHEMBL16449384

CS(=O)(=O)CCOC(=O)I

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
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
SCHEMBL4250054 0.80 ALDH1A1 (0.39) NLRP3
SCHEMBL10669272 0.78 ALDH1A1 (0.46) NLRP3
SCHEMBL4201443 0.78 PLA2G2C (0.33) NLRP3
SCHEMBL10827151 0.78 NLRP3 (0.32) NLRP3
SCHEMBL10841258 0.76 NLRP3 (0.31) NLRP3
SCHEMBL10669266 0.76 NLRP3 (0.31) NLRP3
SCHEMBL112027 0.76 LMNA (0.46) NLRP3
SCHEMBL11316544 0.76 NLRP3 (0.36) NLRP3
SCHEMBL635545 0.76 NLRP3 (0.31) NLRP3
SCHEMBL7156815 0.74 PLA2G2C (0.37) NLRP3

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
EP-1723152-B1 Pyrrolobenzodiazepines SPIROGEN SARL (CH) 2015-02-11 EP disclosed