SCHEMBL13822362

SCHEMBL13822362

C=CC1COC(CC)(C2(CCC)OCC(C=C)O2)O1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 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
SCHEMBL9133607 0.77 TDP1 (0.34) TDP1
SCHEMBL9134152 0.75 TDP1 (0.33) TDP1
SCHEMBL9130929 0.72 TDP1 (0.37) TDP1
SCHEMBL13822372 0.72 TDP1 (0.37) TDP1
SCHEMBL9131612 0.71 TDP1 (0.30) TDP1
SCHEMBL9131939 0.71 TDP1 (0.36) TDP1
SCHEMBL9391499 0.70 TSHR (0.31)
SCHEMBL13822335 0.69 TDP1 (0.31) TDP1
SCHEMBL9131522 0.68 TSHR (0.31) TDP1
SCHEMBL13822477 0.67 TSHR (0.34)

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120308486-A1 Fragrance and/or flavoring compositions containing dioxolanes SYMRISE AG (DE) 2012-12-06 US claimed
EP-2524959-A1 Dioxolanes containing olfactory and/or aromatic substances Symrise AG (DE) 2012-11-21 EP claimed
US-20120308486-A1 Fragrance and/or flavoring compositions containing dioxolanes SYMRISE AG (DE) 2012-12-06 US disclosed
EP-2524959-A1 Dioxolanes containing olfactory and/or aromatic substances Symrise AG (DE) 2012-11-21 EP 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-20120308486-A1 Fragrance and/or flavoring compositions containing dioxolanes FDFT1, DECR1, DOHH TDP1 1510/4885

“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.