SCHEMBL22862035

SCHEMBL22862035

CC(C)C1=CC2=C(C(=O)C1=O)C1CCCC(C)(C)C1CC2

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ FDPS P14324 10/20 0.39
▸ GGPS1 O95749 5/20 0.39
▸ CES1 P23141 4/20 0.36
▸ CES2 O00748 1/20 0.36
▸ EP300 Q09472 1/20 0.36
▸ HIF1A Q16665 1/20 0.33
▸ EPAS1 Q99814 1/20 0.33

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
SCHEMBL29574656 0.70 FDPS (0.50) FDPSGGPS1EP300
SCHEMBL13197140 0.66 FDPS (0.53) FDPSGGPS1EP300
SCHEMBL13201767 0.66 FDPS (0.53) FDPSGGPS1EP300
SCHEMBL12557643 0.65 FDPS (0.45) FDPSGGPS1CES1CES2EP300
SCHEMBL15732245 0.61 EP300 (0.46) FDPSGGPS1EP300HIF1AEPAS1
SCHEMBL29754238 0.61 FDPS (0.48) FDPSGGPS1
SCHEMBL20733401 0.61 FDPS (0.48) FDPSGGPS1
SCHEMBL12564885 0.59 KARS1 (0.43) FDPSGGPS1
SCHEMBL12564878 0.59 KARS1 (0.43) FDPSGGPS1
SCHEMBL18290369 0.58 EP300 (0.56) FDPSGGPS1CES1CES2EP300

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 124/4885GGPS1 522/4885CES1 2023/4885

“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