SCHEMBL26099557

SCHEMBL26099557

C=C(C)C1CCC2([Se]CCCCCCCCCCCC)CC(=O)CC(C)C2(C)C1

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 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
SCHEMBL24968299 0.79 CYP2C19 (0.36) CYP2C19
SCHEMBL23713628 0.77 CYP2C19 (0.35) CYP2C19
SCHEMBL13588603 0.72 CYP2C19 (0.41) CYP2C19
SCHEMBL31046808 0.65 CYP2C19 (0.45) CYP2C19
SCHEMBL27207751 0.61 CYP2C19 (0.40) CYP2C19
SCHEMBL23702675 0.61 CES2 (0.30)
SCHEMBL26189394 0.61 CYP2C19 (0.40) CYP2C19
1,10-Dihydronootkatone SCHEMBL23954040 0.58 CYP2C19 (0.44) CYP2C19
1,10-Dihydronootkatone SCHEMBL20608607 0.58 CYP2C19 (0.44) CYP2C19
SCHEMBL26189395 0.57 CYP2C19 (0.35) CYP2C19

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-20230139806-A1 SELENIDE DERIVATIVES OF FRAGRANCE COMPOUNDS SYMRISE AG (DE) 2023-05-04 US disclosed
EP-4097081-A1 SELENIDE DERIVATIVES OF FRAGRANCE COMPOUNDS Symrise AG (DE) 2022-12-07 EP disclosed
CN-115052859-A Selenide derivatives of fragrance compounds 西姆莱斯股份公司 2022-09-13 CN 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-20230139806-A1 SELENIDE DERIVATIVES OF FRAGRANCE COMPOUNDS SELENOI, FASN, EBP CYP2C19 751/4885

“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.