SCHEMBL16062802

SCHEMBL16062802

CCC1O[C@H](O[C@@H]2C(OCc3ccccc3)[C@H](OCCCC(=O)OC)OC(CO[C@H]3OC(CO[C@H]4OC(CC)[C@@H](C)[C@H](C)C4OC(C)=O)[C@@H](C)[C@H](C)C3OC(=O)c3ccccc3)[C@H]2C)C(OC(C)=O)[C@@H](C)[C@@H]1C

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ SELP P16109 3/20 0.38
▸ NT5E P21589 1/20 0.37
▸ FGF2 P09038 3/20 0.35
▸ MDK P21741 1/20 0.35
▸ TACR1 P25103 3/20 0.35
▸ PTPN1 P18031 2/20 0.35
▸ PTPN2 P17706 1/20 0.35
▸ SSTR2 P30874 3/20 0.34
▸ SSTR3 P32745 3/20 0.34
▸ SSTR5 P35346 3/20 0.34
▸ SSTR1 P30872 1/20 0.34
▸ SSTR4 P31391 1/20 0.34
▸ FGF1 P05230 2/20 0.34
▸ VEGFA P15692 2/20 0.34
▸ HPSE Q9Y251 2/20 0.34
▸ LMNA P02545 2/20 0.34
▸ TNF P01375 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ MCHR1 Q99705 2/20 0.33

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
SCHEMBL16062804 0.96 NT5E (0.38) SELPNT5EFGF2MDKTACR1
SCHEMBL16062805 0.94 NT5E (0.36) SELPNT5EFGF2MDKTACR1
SCHEMBL16062807 0.92 NT5E (0.36) SELPNT5EFGF2MDKTACR1
SCHEMBL16062803 0.92 NT5E (0.36) SELPNT5EFGF2MDKTACR1
SCHEMBL16062799 0.92 NT5E (0.39) SELPNT5ETACR1PTPN1PTPN2
SCHEMBL16849996 0.87 LMNA (0.40) SELPNT5EFGF2MDKTACR1
SCHEMBL9604548 0.84 PTPN1 (0.35) FGF2PTPN1PTPN2FGF1HPSE
SCHEMBL12211060 0.84 PTPN1 (0.37) PTPN1PTPN2LMNA
SCHEMBL16062800 0.83 LGALS8 (0.41) SELPNT5ETACR1SSTR2SSTR3
SCHEMBL9604484 0.83 LMNA (0.38) NT5EPTPN1PTPN2LMNAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180002365-A1 OLIGOSACCHARIDE-PROTEIN CONJUGATES GENZYME CORPORATION 2018-01-04 — — US disclosed
US-9493498-B2 Oligosaccharide-protein conjugates GENZYME CORPORATION (US) 2016-11-15 — — US disclosed
US-20150175643-A1 OLIGOSACCHARIDE-PROTEIN CONJUGATES GENZYME CORPORATION 2015-06-25 — — US disclosed
US-8835614-B2 Oligosaccharide-protein conjugates GENZYME CORPORATION (US) 2014-09-16 — — US disclosed
US-20110300120-A1 OLIGOSACCHARIDE-PROTEIN CONJUGATES GENZYME CORPORATION 2011-12-08 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110300120-A1 OLIGOSACCHARIDE-PROTEIN CONJUGATES MAN2B1, GAA, GBA1 SELP 1706/4885NT5E 2722/4885FGF2 3047/4885
US-20150175643-A1 OLIGOSACCHARIDE-PROTEIN CONJUGATES MAN2B1, GAA, GBA1 SELP 1706/4885NT5E 2722/4885FGF2 3047/4885
US-20180002365-A1 OLIGOSACCHARIDE-PROTEIN CONJUGATES MAN2B1, GAA, GBA1 SELP 1706/4885NT5E 2722/4885FGF2 3047/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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