SCHEMBL4402925

SCHEMBL4402925

CCCCCCCCO[C@H]1OC(CC)[C@@H](C)[C@H](C)C1OO[C@@H]1C(OC(C)=O)[C@@H](O[C@@H]2C(OC(C)=O)[C@@H](O[C@@H]3C(OC(C)=O)COC(COC(C)=O)[C@H]3C)OC(COC(C)=O)[C@H]2C)OC(COC(C)=O)[C@H]1C

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CD44 P16070 1/20 0.37
▸ HPSE Q9Y251 8/20 0.35
▸ FGF1 P05230 6/20 0.35
▸ FGF2 P09038 6/20 0.35
▸ VEGFA P15692 3/20 0.35
▸ BCHE P06276 1/20 0.33
▸ CYP2D6 P10635 2/20 0.32
▸ HSD17B10 Q99714 2/20 0.32
▸ THRB P10828 1/20 0.32
▸ CA2 P00918 2/20 0.32
▸ CA1 P00915 1/20 0.32
▸ CA9 Q16790 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.30
▸ CYP3A4 P08684 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ CYP2C19 P33261 1/20 0.30
▸ MAPK1 P28482 1/20 0.30

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
SCHEMBL4403647 0.89 CYP2D6 (0.37) CD44CYP2D6HSD17B10THRBCA2
SCHEMBL4404462 0.84 LMNA (0.42) HPSEFGF1FGF2VEGFACYP2D6
SCHEMBL2927855 0.75 CYP2D6 (0.53) HPSEFGF1FGF2VEGFACYP2D6
SCHEMBL12920549 0.74 CYP2D6 (0.52) HPSEFGF1FGF2VEGFACYP2D6
SCHEMBL10182606 0.74 ALDH1A1 (0.42) CD44BCHECYP2D6HSD17B10THRB
SCHEMBL10495764 0.74 CYP2D6 (0.55) BCHECYP2D6HSD17B10THRBCA2
SCHEMBL31252904 0.73 CYP2D6 (0.57) BCHECYP2D6HSD17B10THRBCA2
SCHEMBL5181975 0.73 CYP2D6 (0.57) BCHECYP2D6HSD17B10THRBCA2
SCHEMBL4403646 0.72 SLC6A2 (0.36) HPSEFGF1FGF2VEGFABCHE
SCHEMBL17589439 0.72 CYP2D6 (0.47) HPSEFGF1FGF2VEGFACYP2D6

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 CD44 215/4885HPSE 1/4885FGF1 348/4885

“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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