SCHEMBL6928141

SCHEMBL6928141

Cl[Sn](Cl)(Cl)Cl.Oc1ccc(S)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 3/20 0.47
ALDH1A1 P00352 3/20 0.47
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
CA3 P07451 2/20 0.47
CYP3A4 P08684 2/20 0.47
HIF1A Q16665 2/20 0.47
HSD17B10 Q99714 2/20 0.47
CA14 Q9ULX7 2/20 0.47
MAPT P10636 2/20 0.47
KDM4E B2RXH2 1/20 0.47
NPC1 O15118 1/20 0.47
CA12 O43570 1/20 0.47
GMNN O75496 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
LMNA P02545 1/20 0.47
TYR P14679 1/20 0.47
HPGD P15428 1/20 0.47
NFKB1 P19838 1/20 0.47

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
SCHEMBL62871 0.87
SCHEMBL11863520 0.84
SCHEMBL8217008 0.84
Methane SCHEMBL506650 0.84
Water SCHEMBL28352698 0.84
Benzene SCHEMBL28429296 0.81 CA3 (0.53) ALOX15ALDH1A1MEN1KMT2ACA3
SCHEMBL64905 0.79 ESR1 (0.69) ALOX15ALDH1A1MEN1KMT2ACA3
SCHEMBL29086613 0.77 ALOX15 (0.47) ALOX15ALDH1A1MEN1KMT2ACA3
Naphthalene SCHEMBL28954267 0.74 CYP1A2 (0.52) ALOX15ALDH1A1MEN1KMT2ACA3
Chlorobenzene SCHEMBL10877524 0.74 IDO1 (0.55) ALOX15ALDH1A1MEN1KMT2ACA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0686160-A4 SOLUTION AND SOLID-PHASE FORMATION OF GLYCOSIDIC LINKAGES UNIV PRINCETON (US) 2003-03-12 EP disclosed
US-6194393-B1 A GLYCOSIDE CONTAINING AN ANOMERIC SULFOXIDE AND NUCLEOPHILIC FUNCTIONAL GROUPS AND HAVING POTENTIAL GLYCOSYL ACCEPTING/DONATING CHARACTERISTICS AND AN ACTIVATING AGENT; RAPID CONSTRUCTION OLIGOSACCHARIDES; GLYCOSYLATION; LIBRARY THE TRUSTEES OF PRINCETON UNIVERSITY 2001-02-27 US disclosed
US-5861492-A LIBRARIES OF SULFOXIDE-SUBSTITUTED GLYCOSIDES WHICH CAN BIND TO OTHER GLYCOSIDES, STEROIDS, AMINO ACIDS, PEPTIDES, LIPIDS OR POLYCYCLIC AROMATIC COMPOUNDS; FOR RAPID, EFFICIENT, SELECTIVE, MULTIPLE GLYCOSYLATION REACTIONS IN ONE STEP THE TRUSTEES OF PRINCETON UNIVERSITY (US) 1999-01-19 US disclosed
US-5792839-A REACTING GLCOSYL DONOR HAVING ANOMERIC SULFOXIDE GROUP AND GLYCOSYL ACCEPTOR AT LOW TEMPERATURE TRUSTEES OF PRINCETON UNIVERSITY (US) 1998-08-11 US disclosed
US-5700916-A INTERMEDIATES FOR FORMING OLIGOSACCHARIDES, INCLUDING 4-HYDROXYTHIOPHENYL-/2-AZIDO-2-DEOXYGLUCO/PYRANOSIDE TRUSTEES OF PRINCETON UNIVERSITY (US) 1997-12-23 US disclosed
US-5639866-A EXPOSING GLYCOSYL ACCEPTOR BOUND TO SOLID SUPPORT TO GLYCOSIDE HAVING ACTIVATED ANOMERIC SULFOXIDE GROUP, FORMING GLYCOSIDIC BOND PRINCETON UNIVERSITY (US) 1997-06-17 US disclosed
US-5635612-A Method of forming multiple glycosidic linkages in a single step THE TRUSTEES OF PRINCETON UNIVERSITY (US) 1997-06-03 US disclosed
EP-0686160-A1 SOLUTION AND SOLID-PHASE FORMATION OF GLYCOSIDIC LINKAGES THE TRUSTEES OF PRINCETON UNIVERSITY (US) 1995-12-13 EP disclosed
WO-1994019360-A1 SOLUTION AND SOLID-PHASE FORMATION OF GLYCOSIDIC LINKAGES THE TRUSTEES OF PRINCETON UNIVERSITY (US) 1994-09-01 WO disclosed