SCHEMBL1867848

SCHEMBL1867848

CC(=O)OC1=CC(OC(C)=O)OC1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 2/20 0.33
CA12 O43570 2/20 0.31
CA1 P00915 2/20 0.31
CA2 P00918 2/20 0.31
CA9 Q16790 2/20 0.31
L3MBTL1 Q9Y468 1/20 0.30
POLB P06746 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
SCHEMBL11078564 0.72 NLRP3 (0.40) NLRP3POLB
SCHEMBL2951820 0.68 NLRP3 (0.55) NLRP3CA12CA1CA2CA9
SCHEMBL2951827 0.68 NLRP3 (0.55) NLRP3CA12CA1CA2CA9
SCHEMBL28773473 0.65 NLRP3 (0.35) NLRP3
SCHEMBL527820 0.65
SCHEMBL319645 0.63 LMNA (0.31)
SCHEMBL31648648 0.62
SCHEMBL29889544 0.62 LMNA (0.31)
SCHEMBL27778332 0.62 CYP17A1 (0.36) POLB
SCHEMBL2856605 0.62

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-20120302487-A1 COMPOSITE REVOLYMER LIMITED (GB) 2012-11-29 US claimed
EP-2494024-A1 COMPOSITE Revolymer Limited (GB) 2012-09-05 EP claimed
WO-2011051681-A1 COMPOSITE REVOLYMER LIMITED (GB) 2011-05-05 WO claimed
US-20120302487-A1 COMPOSITE REVOLYMER LIMITED (GB) 2012-11-29 US disclosed
EP-2494024-A1 COMPOSITE Revolymer Limited (GB) 2012-09-05 EP disclosed
WO-2011051681-A1 COMPOSITE REVOLYMER LIMITED (GB) 2011-05-05 WO disclosed