SCHEMBL4954660

SCHEMBL4954660

O=C(O[C@H]1O[C@H](CO)[C@@H](OC(=O)c2ccccc2)[C@@H]1OC(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LGALS3 P17931 4/20 0.58
▸ LGALS9 O00182 3/20 0.58
▸ LGALS1 P09382 3/20 0.58
▸ LGALS7; LGALS7B P47929 2/20 0.58
▸ PTPN1 P18031 2/20 0.50
▸ SELP P16109 6/20 0.47
▸ SELE P16581 1/20 0.46
▸ LGALS4 P56470 1/20 0.44
▸ PTPN2 P17706 1/20 0.44
▸ PTPN11 Q06124 1/20 0.44
▸ MAOB P27338 1/20 0.44
▸ LGALS8 O00214 1/20 0.43
▸ ANTXR2 P58335 2/20 0.43
▸ NT5E P21589 1/20 0.43
▸ TMPRSS2 O15393 1/20 0.43
▸ USP2 O75604 1/20 0.43
▸ PDE5A O76074 1/20 0.43
▸ CA1 P00915 1/20 0.43
▸ CA2 P00918 1/20 0.43
▸ HMGCR P04035 1/20 0.43

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
SCHEMBL4534423 1.00 LGALS3 (0.58) LGALS3LGALS9LGALS1LGALS7; LGALS7BPTPN1
SCHEMBL7221498 1.00 LGALS3 (0.58) LGALS3LGALS9LGALS1LGALS7; LGALS7BPTPN1
SCHEMBL15815859 1.00 LGALS3 (0.58) LGALS3LGALS9LGALS1LGALS7; LGALS7BPTPN1
SCHEMBL17318202 1.00 LGALS3 (0.58) LGALS3LGALS9LGALS1LGALS7; LGALS7BPTPN1
SCHEMBL2508264 0.98 LGALS3 (0.56) LGALS3LGALS9LGALS1LGALS7; LGALS7BPTPN1
SCHEMBL14530940 0.98 LGALS3 (0.56) LGALS3LGALS9LGALS1LGALS7; LGALS7BPTPN1
SCHEMBL2506760 0.98 LGALS3 (0.56) LGALS3LGALS9LGALS1LGALS7; LGALS7BPTPN1
SCHEMBL17778306 0.93 LGALS3 (0.52) LGALS3LGALS9LGALS1LGALS7; LGALS7BPTPN1
SCHEMBL17778430 0.93 LGALS3 (0.52) LGALS3LGALS9LGALS1LGALS7; LGALS7BPTPN1
SCHEMBL7799364 0.92 LGALS3 (0.53) LGALS3LGALS9LGALS1LGALS7; LGALS7BPTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1284741-B1 3'-OR 2'-HYDROXYMETHYL SUBSTITUTED NUCLEOSIDE DERIVATIVES FOR TREATMENT OF VIRAL INFECTIONS PHARMASSET INC (US) 2008-11-19 — — EP disclosed
EP-1964569-A2 3'-or 2'-hydroxymethyl substituted nucleoside derivatives for treatment of viral infections Pharmasset, Inc. (US) 2008-09-03 — — EP disclosed
US-7094770-B2 3′-or 2′-hydroxymethyl substituted nucleoside derivatives for treatment of hepatitis virus infections PHARMASSET, LTD. (BB) 2006-08-22 — — US disclosed
EP-1284741-A2 3'-OR 2'-HYDROXYMETHYL SUBSTITUTED NUCLEOSIDE DERIVATIVES FOR TREATMENT OF HEPATITIS VIRUS INFECTIONS Pharmasset, Ltd. (BB) 2003-02-26 — — EP disclosed
US-20020055483-A1 3'-or 2'-hydroxymethyl substituted nucleoside derivatives for treatment of hepatites virus infections PHARMASSET, INC. 2002-05-09 — — US disclosed
WO-2001079246-A2 3'-OR 2'-HYDROXYMETHYL SUBSTITUTED NUCLEOSIDE DERIVATIVES FOR TREATMENT OF HEPATITIS VIRUS INFECTIONS PHARMASSET, LTD. (BB) 2001-10-25 — — WO 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 (1 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-20020055483-A1 3'-or 2'-hydroxymethyl substituted nucleoside derivatives for treatment of hepatites virus infections HCCS, HDGF, HMBS LGALS3 2908/4885LGALS9 3267/4885LGALS1 3333/4885

“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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