SCHEMBL216780

SCHEMBL216780

CC/C(C)=C\CCC(C)(C)OCCCC=O

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.33
TSHR P16473 2/20 0.32

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
SCHEMBL216781 1.00 MAPT (0.33) MAPTTSHR
SCHEMBL217813 0.78 TSHR (0.48) MAPTTSHR
SCHEMBL12526532 0.75 HIF1A (0.35) MAPTTSHR
SCHEMBL215471 0.75 MAPT (0.30) MAPT
SCHEMBL10949134 0.75 TSHR (0.42) MAPTTSHR
SCHEMBL216623 0.74 ALOX15 (0.36) MAPTTSHR
SCHEMBL217042 0.73 MAPT (0.32) MAPTTSHR
SCHEMBL19728613 0.70 ODC1 (0.30)
SCHEMBL19812433 0.69 BTN3A1 (0.38)
SCHEMBL19812434 0.69 BTN3A1 (0.38)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8088725-B2 Fragrance compositions and compounds GIVAUDAN NEDERLAND SERVICES B.V. (NL) 2012-01-03 US disclosed
US-20100132249-A1 Fragrance Compositions and Compounds GIVAUDAN NEDERLAND SERVICES B.V. (NL) 2010-06-03 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-20100132249-A1 Fragrance Compositions and Compounds H1-0, H1-10, H1-5 MAPT 4476/4885TSHR 3815/4885

“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.