SCHEMBL6552374

SCHEMBL6552374

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

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ TACR2 P21452 1/20 0.43
▸ NT5E P21589 1/20 0.42
▸ PTPN1 P18031 5/20 0.42
▸ CDC25B P30305 5/20 0.42
▸ GJB2 P29033 1/20 0.42
▸ PTPN2 P17706 2/20 0.41
▸ PTPN6 P29350 2/20 0.41
▸ PTPN11 Q06124 2/20 0.41
▸ FGF1 P05230 2/20 0.41
▸ FGF2 P09038 2/20 0.41
▸ VEGFA P15692 2/20 0.41
▸ HPSE Q9Y251 2/20 0.41
▸ LGALS8 O00214 1/20 0.41
▸ SSTR5 P35346 2/20 0.39
▸ SLC6A2 P23975 1/20 0.39
▸ SSTR1 P30872 1/20 0.39
▸ SSTR2 P30874 1/20 0.39
▸ SSTR4 P31391 1/20 0.39
▸ SSTR3 P32745 1/20 0.39

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
SCHEMBL6552379 0.91 PTPN1 (0.50) NT5EPTPN1CDC25BPTPN2PTPN6
SCHEMBL6551995 0.90 TACR2 (0.44) TACR2NT5EPTPN1CDC25BGJB2
SCHEMBL6552001 0.90 TACR2 (0.44) TACR2NT5EPTPN1CDC25BGJB2
SCHEMBL6553221 0.89 SSTR1 (0.42) TACR2NT5ESSTR5SSTR1SSTR2
SCHEMBL14409790 0.88 NT5E (0.51) NT5EPTPN1CDC25BPTPN2PTPN6
SCHEMBL14409788 0.84 LGALS8 (0.48) TACR2NT5EPTPN1CDC25BFGF1
SCHEMBL2629592 0.84 LGALS8 (0.48) TACR2NT5EPTPN1CDC25BFGF1
SCHEMBL14075622 0.84 LGALS8 (0.48) TACR2NT5EPTPN1CDC25BFGF1
SCHEMBL10077913 0.84 LGALS8 (0.39) TACR2NT5EPTPN1CDC25BFGF1
SCHEMBL472853 0.83 NT5E (0.44) NT5EPTPN1CDC25BPTPN2PTPN6

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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