SCHEMBL4403647

SCHEMBL4403647

CCC1OC(OC(C)=O)C(OO[C@@H]2C(OC(C)=O)[C@@H](O[C@@H]3C(OC(C)=O)[C@@H](O[C@@H]4C(OC(C)=O)COC(COC(C)=O)[C@H]4C)OC(COC(C)=O)[C@H]3C)OC(COC(C)=O)[C@H]2C)[C@@H](C)[C@@H]1C

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP2D6 P10635 1/20 0.37
▸ THRB P10828 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ CA2 P00918 10/20 0.36
▸ LMNA P02545 1/20 0.35
▸ CD44 P16070 1/20 0.34
▸ NR3C1 P04150 1/20 0.34
▸ FYN P06241 1/20 0.34
▸ ADRA2A P08913 1/20 0.34
▸ ADORA3 P0DMS8 1/20 0.34
▸ ADRA2B P18089 1/20 0.34
▸ DRD4 P21917 1/20 0.34
▸ DRD3 P35462 1/20 0.34
▸ CA1 P00915 9/20 0.34
▸ CA9 Q16790 9/20 0.34
▸ CA12 O43570 8/20 0.34
▸ PRKCA P17252 1/20 0.33
▸ AKT1 P31749 1/20 0.33
▸ PTK2 Q05397 1/20 0.33
▸ P4HB P07237 1/20 0.32

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
SCHEMBL4402925 0.89 CD44 (0.37) CYP2D6THRBHSD17B10CA2CD44
SCHEMBL4404462 0.87 LMNA (0.42) CYP2D6CA2LMNACA1CA9
SCHEMBL16169888 0.79 CYP2D6 (0.52) CYP2D6THRBHSD17B10CA2NR3C1
SCHEMBL15298599 0.78 OGA (0.38) CYP2D6THRBHSD17B10CA2LMNA
SCHEMBL12171612 0.78 CYP2D6 (0.47) CYP2D6THRBHSD17B10CA2LMNA
SCHEMBL12171622 0.77 CYP2D6 (0.46) CYP2D6THRBHSD17B10CA2LMNA
SCHEMBL12588466 0.76 CYP2D6 (0.48) CYP2D6THRBHSD17B10CA2LMNA
SCHEMBL25549460 0.76 OGA (0.35) CYP2D6THRBHSD17B10CA2LMNA
SCHEMBL14429311 0.75 CYP2D6 (0.56) CYP2D6THRBHSD17B10CA2LMNA
SCHEMBL22965568 0.74 CYP2D6 (0.55) CYP2D6THRBHSD17B10CA2NR3C1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8173606-B2 Sulfated oligosaccharide derivatives PROGEN PHARMACEUTICALS LIMITED (AU) 2012-05-08 — — US disclosed
US-20110130354-A1 SULFATED OLIGOSACCHARIDE DERIVATIVES PROGEN PHARMACEUTICALS LIMITED (AU) 2011-06-02 — — 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 (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-20110130354-A1 SULFATED OLIGOSACCHARIDE DERIVATIVES HPSE, APOB, LIPG CYP2D6 2537/4885THRB 2308/4885HSD17B10 397/4885

“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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