SCHEMBL4404462

SCHEMBL4404462

CCC1O[C@H](OCc2ccccc2)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 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.42
▸ CYP2D6 P10635 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ POLB P06746 1/20 0.38
▸ CA9 Q16790 6/20 0.38
▸ CA1 P00915 5/20 0.38
▸ CA2 P00918 5/20 0.38
▸ KMT2A Q03164 1/20 0.37
▸ SLC6A2 P23975 2/20 0.37
▸ TSHR P16473 1/20 0.36
▸ PRKCA P17252 1/20 0.36
▸ AKT1 P31749 1/20 0.36
▸ PTK2 Q05397 1/20 0.36
▸ FGF1 P05230 2/20 0.35
▸ FGF2 P09038 2/20 0.35
▸ VEGFA P15692 2/20 0.35
▸ HPSE Q9Y251 2/20 0.35
▸ PAX8 Q06710 1/20 0.35
▸ CA12 O43570 2/20 0.34

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
SCHEMBL4403646 0.88 SLC6A2 (0.36) SLC6A2FGF1FGF2VEGFAHPSE
SCHEMBL4403647 0.87 CYP2D6 (0.37) LMNACYP2D6CA9CA1CA2
SCHEMBL4402925 0.84 CD44 (0.37) CYP2D6ALDH1A1MAPK1CA9CA1
SCHEMBL15504367 0.79 LMNA (0.56) LMNACYP2D6ALDH1A1MAPK1POLB
SCHEMBL15504402 0.79 LMNA (0.56) LMNACYP2D6ALDH1A1MAPK1POLB
SCHEMBL12917695 0.78 LMNA (0.55) LMNACYP2D6ALDH1A1MAPK1POLB
SCHEMBL19726109 0.77 FGF1 (0.39) LMNACYP2D6ALDH1A1MAPK1POLB
SCHEMBL17521922 0.77 LMNA (0.52) LMNACYP2D6ALDH1A1MAPK1POLB
SCHEMBL17521906 0.77 LMNA (0.52) LMNACYP2D6ALDH1A1MAPK1POLB
SCHEMBL17521916 0.77 LMNA (0.49) LMNACYP2D6ALDH1A1MAPK1POLB

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 LMNA 3847/4885CYP2D6 2537/4885ALDH1A1 3329/4885

“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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