SCHEMBL19274834

SCHEMBL19274834

CC(C)(C)[C@@]12C[C@@H]3OC(=O)C[C@@]34C(=O)O[C@@H]3OC(=O)[C@H](O1)[C@@]342

nearest known ligand 0.62

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.62
▸ THRB P10828 1/20 0.62
▸ ALOX15 P16050 1/20 0.62
▸ KMT2A Q03164 1/20 0.62
▸ SMN1; SMN2 Q16637 1/20 0.62

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
Bilobalide SCHEMBL13960090 0.77 KMT2A (1.00) MEN1THRBALOX15KMT2ASMN1; SMN2
Bilobalide SCHEMBL16452769 0.77 KMT2A (1.00) MEN1THRBALOX15KMT2ASMN1; SMN2
Bilobalide SCHEMBL19236272 0.77 KMT2A (1.00) MEN1THRBALOX15KMT2ASMN1; SMN2
Bilobalide SCHEMBL18327718 0.77 KMT2A (1.00) MEN1THRBALOX15KMT2ASMN1; SMN2
Bilobalide SCHEMBL16653675 0.77 KMT2A (1.00) MEN1THRBALOX15KMT2ASMN1; SMN2
Bilobalide SCHEMBL14029382 0.77 KMT2A (1.00) MEN1THRBALOX15KMT2ASMN1; SMN2
SCHEMBL20466268 0.59 MEN1 (0.51) MEN1THRBALOX15KMT2ASMN1; SMN2
SCHEMBL14047654 0.58 KMT2A (0.54) MEN1THRBALOX15KMT2ASMN1; SMN2
SCHEMBL15721260 0.58 KMT2A (0.54) MEN1THRBALOX15KMT2ASMN1; SMN2
SCHEMBL20625694 0.58 KMT2A (0.54) MEN1THRBALOX15KMT2ASMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200178542-A9 CONTROL OF PESTS IN COTTON BY GINKGOLIDES AND BILOBALIDES BASF SE (DE) 2020-06-11 — — US disclosed
US-10334859-B2 Method and pesticidal mixtures for controlling Pentatomidae pests BASF SE (DE) 2019-07-02 — — US disclosed
US-20170238554-A1 Method and Pesticidal Mixtures for Controlling Pentatomidae Pests BASF CORPORATION 2017-08-24 — — 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 (3 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-10334859-B2 Method and pesticidal mixtures for controlling Pentatomidae pests CASP9, CASP6, CASP14 MEN1 1446/4885THRB 1921/4885ALOX15 1149/4885
US-20200178542-A9 CONTROL OF PESTS IN COTTON BY GINKGOLIDES AND BILOBALIDES GAK, GLMN, GYPA MEN1 2565/4885THRB 1963/4885ALOX15 1030/4885
US-20170238554-A1 Method and Pesticidal Mixtures for Controlling Pentatomidae Pests CASP9, CASP6, CASP14 MEN1 1446/4885THRB 1921/4885ALOX15 1149/4885

“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