Methyl Dihydrobetulonate

Methyl Dihydrobetulonate

SCHEMBL13747683

COC(=O)C12CCC(C(C)C)C1C1CCC3C4(C)CCC(=O)C(C)(C)C4CCC3(C)[C@]1(C)CC2

nearest known ligand 0.58

Full drug profile on Sugi Atlas →

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ GPBAR1 Q8TDU6 14/20 0.58
▸ LMNA P02545 1/20 0.58
▸ NT5E P21589 1/20 0.58
▸ SMN1; SMN2 Q16637 1/20 0.58
▸ PRKCD Q05655 1/20 0.55
▸ NR1H4 Q96RI1 1/20 0.52

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
SCHEMBL9891261 0.92 GPBAR1 (0.57) GPBAR1LMNANT5ESMN1; SMN2PRKCD
Dihydrobetulonic Acid SCHEMBL10061167 0.89 GPBAR1 (0.71) GPBAR1LMNANT5ESMN1; SMN2PRKCD
Dihydrobetulonic Acid SCHEMBL13908784 0.89 GPBAR1 (0.71) GPBAR1LMNANT5ESMN1; SMN2PRKCD
Dihydrobetulonic Acid SCHEMBL14414141 0.89 GPBAR1 (0.71) GPBAR1LMNANT5ESMN1; SMN2PRKCD
Dihydrobetulonic Acid SCHEMBL3276418 0.89 GPBAR1 (0.71) GPBAR1LMNANT5ESMN1; SMN2PRKCD
SCHEMBL10061168 0.89 GPBAR1 (0.59) GPBAR1LMNANT5ESMN1; SMN2PRKCD
SCHEMBL16511700 0.89 GPBAR1 (0.59) GPBAR1LMNANT5ESMN1; SMN2PRKCD
SCHEMBL13908786 0.88 GPBAR1 (0.55) GPBAR1LMNANT5ESMN1; SMN2PRKCD
SCHEMBL13908792 0.88 GPBAR1 (0.55) GPBAR1LMNANT5ESMN1; SMN2PRKCD
SCHEMBL2620463 0.85 GPBAR1 (0.51) GPBAR1LMNANT5ESMN1; SMN2PRKCD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090203661-A1 Betulinic acid, derivatives and analogs thereof and uses therefor SAFE STEPHEN H 2009-08-13 — — 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-20090203661-A1 Betulinic acid, derivatives and analogs thereof and uses therefor BET1, SREBF1, BCOR GPBAR1 671/4885LMNA 3203/4885NT5E 4087/4885

“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.

Send feedback