SCHEMBL6552379

SCHEMBL6552379

CC(C)(C)C(=O)OC[C@H]1O[C@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@@H](OCc2ccccc2)[C@H]1OCc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 11/20 0.50
▸ CDC25B P30305 8/20 0.50
▸ PTPN2 P17706 6/20 0.48
▸ PTPN11 Q06124 5/20 0.48
▸ PTPN6 P29350 4/20 0.48
▸ NT5E P21589 1/20 0.48
▸ SSTR1 P30872 1/20 0.47
▸ SSTR2 P30874 1/20 0.47
▸ SSTR4 P31391 1/20 0.47
▸ SSTR3 P32745 1/20 0.47
▸ SSTR5 P35346 1/20 0.47
▸ BCHE P06276 1/20 0.43
▸ TACR1 P25103 1/20 0.42

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
SCHEMBL14409790 0.94 NT5E (0.51) PTPN1CDC25BPTPN2PTPN11PTPN6
SCHEMBL6552374 0.91 TACR2 (0.43) PTPN1CDC25BPTPN2PTPN11PTPN6
SCHEMBL6553224 0.89 SSTR1 (0.50) PTPN1CDC25BNT5ESSTR1SSTR2
SCHEMBL472853 0.87 NT5E (0.44) PTPN1CDC25BPTPN2PTPN11PTPN6
SCHEMBL3490348 0.83 TACR2 (0.39) PTPN1CDC25BPTPN2PTPN11PTPN6
SCHEMBL6553262 0.82 SSTR1 (0.44) NT5ESSTR1SSTR2SSTR4SSTR3
SCHEMBL6553266 0.82 SSTR1 (0.44) NT5ESSTR1SSTR2SSTR4SSTR3
SCHEMBL6551995 0.82 TACR2 (0.44) PTPN1CDC25BPTPN2PTPN11PTPN6
SCHEMBL6552001 0.82 TACR2 (0.44) PTPN1CDC25BPTPN2PTPN11PTPN6
SCHEMBL38652098 0.82 PTPN1 (0.49) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1018515-B1 Oligosaccharide, method for producing it and pharmaceutical composition containing it SEIKAGAKU KOGYO CO LTD (JP) 2004-02-18 — — EP disclosed
US-6562954-B1 Oligosaccharide for use as tool in human therapeutics SEIKAGAKU CORPORATION (JP) 2003-05-13 — — US disclosed
EP-1018515-A1 Oligosaccharide, method for producing it and pharmaceutical composition containing it SEIKAGAKU CORPORATION (JP) 2000-07-12 — — EP disclosed
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