SCHEMBL11969845

SCHEMBL11969845

CS(=O)(=O)CS(=O)(=O)O.[NaH]

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.32
PDE4A P27815 1/20 0.32
LMNA P02545 1/20 0.32
SLC6A6 P31641 1/20 0.32
CYP2C19 P33261 1/20 0.32
BLM P54132 1/20 0.32
KDM4E B2RXH2 1/20 0.31
CYP3A4 P08684 1/20 0.31
CA5A P35218 1/20 0.31
CA5B Q9Y2D0 1/20 0.31
CA2 P00918 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
SCHEMBL5471678 0.97
SCHEMBL31174802 0.83 USP2 (0.32) LMNAKDM4E
SCHEMBL1756114 0.79 CA2 (0.41) PTGS1PDE4ALMNASLC6A6CYP2C19
SCHEMBL8746848 0.78 CA5A (0.42) PTGS1PDE4ALMNASLC6A6CYP2C19
SCHEMBL14975134 0.78 CA5A (0.42) PTGS1PDE4ALMNASLC6A6CYP2C19
SCHEMBL7869614 0.76
SCHEMBL28856272 0.74 CA5A (0.39) PTGS1PDE4ALMNASLC6A6CYP2C19
SCHEMBL28010977 0.74 CA5A (0.39) PTGS1PDE4ALMNASLC6A6CYP2C19
SCHEMBL28187570 0.74 CA5A (0.39) PTGS1PDE4ALMNASLC6A6CYP2C19
SCHEMBL28199874 0.74 CA5A (0.39) PTGS1PDE4ALMNASLC6A6CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2831040-A1 PROCESS FOR RECOVERING AND RECYCLING AN ACID CATALYST Eastman Chemical Company (US) 2015-02-04 EP disclosed
US-8785686-B2 Process for recovering and recycling an acid catalyst EASTMAN CHEMICAL COMPANY (US) 2014-07-22 US disclosed
WO-2013148497-A1 PROCESS FOR RECOVERING AND RECYCLING AN ACID CATALYST EASTMAN CHEMICAL COMPANY (US) 2013-10-03 WO disclosed
US-20120215027-A1 PROCESS FOR RECOVERING AND RECYCLING AN ACID CATALYST EASTMAN CHEMICAL COMPANY (US) 2012-08-23 US disclosed