SCHEMBL6473002

SCHEMBL6473002

CS(=O)(=O)N(CCOCCN(S(C)(=O)=O)S(C)(=O)=O)S(C)(=O)=O

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
USP2 O75604 2/20 0.33
TSHR P16473 2/20 0.33
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
MMP9 P14780 1/20 0.32
ALOX15 P16050 1/20 0.32
BLM P54132 1/20 0.31
PMP22 Q01453 1/20 0.31
HSD17B10 Q99714 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
SCHEMBL19846863 0.85 TSHR (0.44) TSHRALDH1A1
SCHEMBL7567519 0.78 KDM4E (0.36) KDM4E
SCHEMBL7195249 0.74
SCHEMBL145294 0.71 CHRM2 (0.30)
SCHEMBL4666266 0.71 CA1 (0.48)
SCHEMBL2595019 0.69 TSHR (0.43) TSHRALDH1A1BLMPMP22HSD17B10
SCHEMBL5020908 0.69 MEN1 (0.34)
SCHEMBL4613179 0.69
SCHEMBL5176138 0.69 MAPT (0.38)
SCHEMBL2731669 0.69 TRPA1 (0.36)

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-1556429-A1 POLYURETHANE ELASTOMERS, METHOD FOR THE PRODUCTION THEREOF AND USE OF THE SAME Bayer MaterialScience AG (DE) 2005-07-27 EP disclosed
WO-2004037882-A1 POLYURETHANE ELASTOMERS, METHOD FOR THE PRODUCTION THEREOF AND USE OF THE SAME BAYER MATERIALSCIENCE AG (DE) 2004-05-06 WO disclosed
EP-1206348-A1 METHOD OF PRODUCING VEHICLE INTERIOR MATERIAL HAVING SANDWICH STRUCTURE Bayer Aktiengesellschaft (DE) 2002-05-22 EP disclosed
WO-2001010637-A1 METHOD OF PRODUCING VEHICLE INTERIOR MATERIAL HAVING SANDWICH STRUCTURE BAYER AKTIENGESELLSCHAFT (DE) 2001-02-15 WO disclosed