SCHEMBL9853892

SCHEMBL9853892

C=CCO[C@@H]1[C@@H](OCc2ccccc2)[C@@H](OCc2ccccc2)O[C@H](COCc2ccccc2)[C@H]1OCc1ccccc1

nearest known ligand 0.66

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 9/20 0.52
CDC25B P30305 8/20 0.52
PTPN2 P17706 5/20 0.52
PTPN11 Q06124 5/20 0.52
PTPN6 P29350 4/20 0.52
SSTR1 P30872 2/20 0.51
SSTR2 P30874 2/20 0.51
SSTR4 P31391 2/20 0.51
SSTR3 P32745 2/20 0.51
SSTR5 P35346 2/20 0.51
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
CA9 Q16790 1/20 0.49
NT5E P21589 1/20 0.49
HTR1A P08908 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
SCHEMBL9853891 1.00 PTPN1 (0.52) PTPN1CDC25BPTPN2PTPN11PTPN6
SCHEMBL2589256 0.98 SSTR1 (0.51) PTPN1CDC25BPTPN2PTPN11PTPN6
SCHEMBL12468632 0.98 SSTR1 (0.51) PTPN1CDC25BPTPN2PTPN11PTPN6
SCHEMBL8721436 0.96 SSTR1 (0.52) PTPN1CDC25BPTPN2PTPN11PTPN6
SCHEMBL8721432 0.96 SSTR1 (0.52) PTPN1CDC25BPTPN2PTPN11PTPN6
SCHEMBL2290681 0.96 SSTR1 (0.52) PTPN1CDC25BPTPN2PTPN11PTPN6
SCHEMBL6265877 0.96 SSTR1 (0.52) PTPN1CDC25BPTPN2PTPN11PTPN6
SCHEMBL12380695 0.96 SSTR1 (0.52) PTPN1CDC25BPTPN2PTPN11PTPN6
SCHEMBL6553536 0.95 SSTR1 (0.51) PTPN1CDC25BPTPN2PTPN11PTPN6
SCHEMBL6553544 0.95 SSTR1 (0.51) PTPN1CDC25BPTPN2PTPN11PTPN6

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-0416396-A2 Tetrasaccharides and process for their preparation MERCK PATENT GmbH (DE) 1991-03-13 EP disclosed