SCHEMBL22861901

SCHEMBL22861901

COc1c(C(C)C)c(O)c(O)c2c1C(OC)C1OC(=O)C23CCCC(C)(C)C13

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ FDPS P14324 7/20 0.40
▸ PTGES O14684 1/20 0.40
▸ PNLIP P16233 1/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ GGPS1 O95749 4/20 0.36

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
SCHEMBL22861902 0.78 — —
SCHEMBL31238108 0.78 FDPS (0.61) FDPSPTGESPNLIPMEN1KMT2A
Rosmanol SCHEMBL13062163 0.68 FDPS (0.65) FDPSPTGESPNLIPMEN1KMT2A
Epirosmanol SCHEMBL3272202 0.68 FDPS (0.65) FDPSPTGESPNLIPMEN1KMT2A
Epirosmanol SCHEMBL29426648 0.68 FDPS (0.65) FDPSPTGESPNLIPMEN1KMT2A
Rosmanol SCHEMBL459610 0.68 FDPS (0.65) FDPSPTGESPNLIPMEN1KMT2A
Rosmanol SCHEMBL28962181 0.68 FDPS (0.65) FDPSPTGESPNLIPMEN1KMT2A
SCHEMBL29385649 0.67 FDPS (0.64) FDPSPTGESPNLIPMEN1KMT2A
Taiwaniaquinol C SCHEMBL31237206 0.65 PIK3CA (0.33) FDPSMEN1KMT2AGGPS1
Taiwaniaquinol B SCHEMBL31237215 0.63 USP2 (0.37) FDPSPTGESPNLIPMEN1KMT2A

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-20210000841-A1 COMPOUNDS THAT MODULATE VON WILLEBRAND FACTOR LEVELS AND THEIR USE IN THE TREATMENT OF BLOOD DISORDERS SOCIETE DES PRODUITS NESTLE S.A. (CH) 2021-01-07 — — 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-20210000841-A1 COMPOUNDS THAT MODULATE VON WILLEBRAND FACTOR LEVELS AND THEIR USE IN THE TREATMENT OF BLOOD DISORDERS F5, F2, F3 FDPS 124/4885PTGES 247/4885PNLIP 933/4885

“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