SCHEMBL9898618

SCHEMBL9898618

NC(=O)OC1C(O)C(CO)OC(O[C@@H]2[C@H](OCCOCCNC(=O)CCCC[C@@H]3SC[C@@H]4NC(=O)N[C@@H]43)O[C@@H](CO)[C@@H](O)[C@@H]2O)C1O

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MDK P21741 4/20 0.65
▸ FGF1 P05230 1/20 0.64
▸ FGF2 P09038 1/20 0.64
▸ VEGFA P15692 1/20 0.64
▸ HPSE Q9Y251 1/20 0.64
▸ PKM P14618 2/20 0.50
▸ PRSS1 P07477 2/20 0.49
▸ PRSS2 P07478 2/20 0.49
▸ PRSS3 P35030 2/20 0.49
▸ TPSAB1 Q15661 2/20 0.49
▸ F2 P00734 1/20 0.49
▸ FOLH1 Q04609 4/20 0.49
▸ TDP1 Q9NUW8 1/20 0.47
▸ PLCD1 P51178 1/20 0.44
▸ HSP90AB1 P08238 1/20 0.43
▸ CA12 O43570 1/20 0.43
▸ CA1 P00915 1/20 0.43
▸ CA2 P00918 1/20 0.43
▸ CA9 Q16790 1/20 0.43
▸ KDM1A O60341 1/20 0.42

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
SCHEMBL9898615 1.00 MDK (0.65) MDKFGF1FGF2VEGFAHPSE
SCHEMBL9898612 1.00 MDK (0.65) MDKFGF1FGF2VEGFAHPSE
SCHEMBL16264872 0.81 MDK (0.75) MDKFGF1FGF2VEGFAHPSE
SCHEMBL18653674 0.81 MDK (0.75) MDKFGF1FGF2VEGFAHPSE
SCHEMBL12975856 0.78 MDK (0.56) MDKFGF1FGF2VEGFAHPSE
SCHEMBL19751698 0.78 F2 (0.73) PKMPRSS1PRSS2PRSS3TPSAB1
SCHEMBL19017236 0.78 F2 (0.73) PKMPRSS1PRSS2PRSS3TPSAB1
SCHEMBL4968230 0.78 F2 (0.73) PKMPRSS1PRSS2PRSS3TPSAB1
SCHEMBL15216220 0.78 F2 (0.73) PKMPRSS1PRSS2PRSS3TPSAB1
SCHEMBL8239820 0.77 FGF1 (0.51) MDKFGF1FGF2VEGFAHPSE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9624255-B2 Carbohydrate-mediated tumor targeting ARIZONA BOARD OF REGENTS (US) 2017-04-18 — — US claimed
US-20120148502-A1 Carbohydrate-Mediated Tumor Targeting Arizona Board of Regents, a body corporate of the State of Ariz. acting for and on behalf of Ariz. (US) 2012-06-14 — — US claimed
US-9624255-B2 Carbohydrate-mediated tumor targeting ARIZONA BOARD OF REGENTS (US) 2017-04-18 — — US disclosed
US-20120148502-A1 Carbohydrate-Mediated Tumor Targeting Arizona Board of Regents, a body corporate of the State of Ariz. acting for and on behalf of Ariz. (US) 2012-06-14 — — 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-20120148502-A1 Carbohydrate-Mediated Tumor Targeting CA14, CA13, CA12 MDK 2783/4885FGF1 825/4885FGF2 498/4885

“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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