SCHEMBL22861893

SCHEMBL22861893

CC(C)C1=C(O)C(=O)C2=C(C=C[C@H]3C(C)(C)CCC[C@]23C)C1=O

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ EP300 Q09472 1/20 0.41
▸ FDPS P14324 4/20 0.35
▸ CYP19A1 P11511 2/20 0.33
▸ USP2 O75604 2/20 0.31
▸ HSP90AA1 P07900 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ TP53 P04637 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ GGPS1 O95749 1/20 0.31

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
Horminone SCHEMBL22861891 0.71 CYP19A1 (0.45) EP300FDPSCYP19A1USP2HSP90AA1
Horminone SCHEMBL22861860 0.71 CYP19A1 (0.45) EP300FDPSCYP19A1USP2HSP90AA1
SCHEMBL21291505 0.70 EP300 (0.40) EP300FDPSCYP19A1USP2HSP90AA1
SCHEMBL22861899 0.69 EP300 (0.42) EP300FDPSCYP19A1GGPS1
Royleanone SCHEMBL16006778 0.69 CYP3A4 (0.44) EP300FDPSCYP19A1USP2HSP90AA1
Royleanone SCHEMBL21291506 0.69 CYP3A4 (0.44) EP300FDPSCYP19A1USP2HSP90AA1
SCHEMBL22861898 0.69 EP300 (0.42) EP300FDPSCYP19A1GGPS1
SCHEMBL14303936 0.69 EP300 (0.40) EP300FDPSCYP19A1GGPS1
SCHEMBL31150123 0.68 EP300 (0.31) EP300
SCHEMBL29526053 0.68 EP300 (0.31) EP300

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 EP300 4632/4885FDPS 124/4885CYP19A1 1873/4885

“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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