Betulin Diacetate

Betulin Diacetate

SCHEMBL10001907

C=C(C)[C@@H]1CCC2(COC(C)=O)CC[C@]3(C)C(CCC4C5(C)CCC(OC(C)=O)C(C)(C)C5CCC43C)C12

nearest known ligand 0.85

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Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC10A1 Q14973 1/20 0.85
CA9 Q16790 4/20 0.81
PTGES O14684 2/20 0.71
CA1 P00915 1/20 0.68
CA2 P00918 1/20 0.68
PRKCD Q05655 1/20 0.63
NT5E P21589 2/20 0.61
CETP P11597 1/20 0.61
USP2 O75604 1/20 0.61
LMNA P02545 1/20 0.61
HIF1A Q16665 1/20 0.61
TOP2A P11388 1/20 0.61
PTPN1 P18031 1/20 0.61
RELA Q04206 1/20 0.61

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
Betulin Diacetate SCHEMBL21800881 1.00 SLC10A1 (0.85) SLC10A1CA9PTGESCA1CA2
Betulin Diacetate SCHEMBL10152757 1.00 SLC10A1 (0.85) SLC10A1CA9PTGESCA1CA2
Betulin Diacetate SCHEMBL2734061 1.00 SLC10A1 (0.85) SLC10A1CA9PTGESCA1CA2
Betulin Diacetate SCHEMBL6112851 1.00 SLC10A1 (0.85) SLC10A1CA9PTGESCA1CA2
Betulin Diacetate SCHEMBL2734684 1.00 SLC10A1 (0.85) SLC10A1CA9PTGESCA1CA2
Betulin Diacetate SCHEMBL14339168 1.00 SLC10A1 (0.85) SLC10A1CA9PTGESCA1CA2
Betulin Diacetate SCHEMBL10523254 1.00 SLC10A1 (0.85) SLC10A1CA9PTGESCA1CA2
Betulin Diacetate SCHEMBL14134382 1.00 SLC10A1 (0.85) SLC10A1CA9PTGESCA1CA2
SCHEMBL14344558 0.95 SLC10A1 (0.78) SLC10A1CA9PTGESCA1CA2
SCHEMBL14368363 0.95 SLC10A1 (0.78) SLC10A1CA9PTGESCA1CA2

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-8093413-B2 Method of preparation and isolation of betulin diacetate from birch bark from paper mills and its optical processing to betulin UNIVERZITA KARLOVA V PRAZE, PRIRODOVEDECKA FAKULTA (CZ) 2012-01-10 US disclosed
US-20090318719-A1 METHOD OF PREPARATION AND ISOLATION OF BETULIN DIACETATE FROM BIRCH BARK FROM PAPER MILLS AND ITS OPTIONAL PROCESSING TO BETULIN UNIVERZITA PALACKEHO V OLOMOUCI (CZ) 2009-12-24 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-20090318719-A1 METHOD OF PREPARATION AND ISOLATION OF BETULIN DIACETATE FROM BIRCH BARK FROM PAPER MILLS AND ITS OPTIONAL PROCESSING TO BETULIN BET1, BRD4, BRWD1 SLC10A1 3891/4885CA9 114/4885PTGES 3003/4885

“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.