SCHEMBL13293167

SCHEMBL13293167

C=C(C(C)=O)[C@@H]1CC[C@]2(COC(C)=O)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(COC(C)=O)[C@@H]5CC[C@]43C)[C@@H]12

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ SLC10A1 Q14973 1/20 0.58
▸ GPBAR1 Q8TDU6 3/20 0.53
▸ LMNA P02545 2/20 0.53
▸ NT5E P21589 2/20 0.53
▸ SMN1; SMN2 Q16637 1/20 0.53
▸ CA9 Q16790 4/20 0.50
▸ CA1 P00915 1/20 0.47
▸ CA2 P00918 1/20 0.47
▸ PTGES O14684 1/20 0.47
▸ USP2 O75604 1/20 0.45
▸ HIF1A Q16665 1/20 0.45
▸ TOP2A P11388 1/20 0.45
▸ PTPN1 P18031 1/20 0.45
▸ RELA Q04206 1/20 0.45
▸ F3 P13726 1/20 0.44

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
SCHEMBL13293224 0.93 SLC10A1 (0.60) SLC10A1GPBAR1LMNANT5ESMN1; SMN2
SCHEMBL13293148 0.91 SLC10A1 (0.71) SLC10A1GPBAR1LMNANT5ESMN1; SMN2
SCHEMBL13293245 0.90 SLC10A1 (0.57) SLC10A1GPBAR1LMNANT5ESMN1; SMN2
SCHEMBL13293196 0.88 SLC10A1 (0.60) SLC10A1GPBAR1LMNANT5ESMN1; SMN2
SCHEMBL13293259 0.88 PTGES (0.62) SLC10A1GPBAR1LMNANT5ESMN1; SMN2
SCHEMBL13304150 0.87 SLC10A1 (0.70) SLC10A1GPBAR1LMNANT5ESMN1; SMN2
SCHEMBL13910811 0.86 GPBAR1 (0.62) SLC10A1GPBAR1LMNANT5ESMN1; SMN2
SCHEMBL23626105 0.85 GPBAR1 (0.70) SLC10A1GPBAR1LMNANT5ESMN1; SMN2
SCHEMBL13098061 0.85 GPBAR1 (0.70) SLC10A1GPBAR1LMNANT5ESMN1; SMN2
SCHEMBL13910810 0.85 GPBAR1 (0.70) SLC10A1GPBAR1LMNANT5ESMN1; SMN2

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-20100144688-A1 23-Substituted Derivatives of Lupane-type Pentacyclic Triterpenoids ADVANCED LIFE SCIENCES, INC. (US) 2010-06-10 — — 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-20100144688-A1 23-Substituted Derivatives of Lupane-type Pentacyclic Triterpenoids BRCA1, PGF, LSS SLC10A1 2053/4885GPBAR1 465/4885LMNA 1419/4885

“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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