SCHEMBL874985

SCHEMBL874985

C=CCOC(C)CC(C)C

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.37
TSHR P16473 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 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
SCHEMBL18959713 1.00 TDP1 (0.37) TDP1TSHRCA1CA2CA9
SCHEMBL19694298 0.82 TDP1 (0.32) TDP1CA1CA2CA9MEN1
SCHEMBL15668409 0.80 CA1 (0.34) TDP1CA1CA2MEN1KMT2A
SCHEMBL925203 0.79
SCHEMBL12786327 0.79
SCHEMBL674071 0.79
SCHEMBL16351268 0.79
SCHEMBL10705298 0.79
SCHEMBL16667753 0.79
SCHEMBL13177466 0.78

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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109310602-B Fragrance material 高砂香料工业株式会社 2022-06-28 CN claimed
CN-113950358-A Film-forming composition 花王株式会社 2022-01-18 CN claimed
US-20190177653-A1 FRAGRANCE MATERIAL TAKASAGO INTERNATIONAL CORPORATION (JP) 2019-06-13 US claimed
EP-3468527-A1 FRAGRANCE MATERIAL Takasago International Corporation (JP) 2019-04-17 EP claimed
WO-2017214446-A1 FRAGRANCE MATERIAL TAKASAGO INTERNATIONAL CORPORATION (USA) (US) 2017-12-14 WO claimed
EP-1433476-B2 Skin cleansing composition KAO CORP (JP) 2013-07-24 EP claimed
EP-1433476-B1 Skin cleansing composition KAO CORP (JP) 2006-03-22 EP claimed
EP-4331685-A1 AEROSOL COSMETIC Kao Corporation (JP) 2024-03-06 EP disclosed
CN-109310602-B Fragrance material 高砂香料工业株式会社 2022-06-28 CN disclosed
US-10774289-B2 Fragrance material TAKASAGO INTERNATIONAL CORPORATION (JP) 2020-09-15 US disclosed
EP-2438902-B1 CLEANSING METHOD KAO CORP (JP) 2020-02-26 EP disclosed
US-20190177653-A1 FRAGRANCE MATERIAL TAKASAGO INTERNATIONAL CORPORATION (JP) 2019-06-13 US disclosed
EP-3468527-A1 FRAGRANCE MATERIAL Takasago International Corporation (JP) 2019-04-17 EP disclosed
EP-1568357-B1 Cleansing composition and cleansing sheet KAO CORP (JP) 2016-11-30 EP disclosed
WO-2016154120-A1 POLYPEPTIDES, PEPTIDES, AND PROTEINS FUNCTIONALIZED BY ALKYLATION OF THIOETHER GROUPS VIA RING-OPENING REACTIONS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2016-09-29 WO disclosed
US-20120073591-A1 METHOD OF CLEANSING KAO CORPORATION (JP) 2012-03-29 US disclosed
EP-1514872-B1 Phosphorylated glyceryl ether aluminium salts KAO CORP (JP) 2006-11-22 EP disclosed
EP-1568357-A1 Cleansing composition and cleansing sheet Kao Corporation (JP) 2005-08-31 EP disclosed
US-20050186167-A1 Cleansing composition and cleansing sheet KAO CORPORATION (JP) 2005-08-25 US disclosed
CN-1626538-A Phosphorylated glyceryl ether aluminium salts KAO CORP (JP) 2005-06-15 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 (2 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-20190177653-A1 FRAGRANCE MATERIAL HTR5A, FAAH2, HRH1 TDP1 2360/4885TSHR 4233/4885CA1 3847/4885
US-10774289-B2 Fragrance material HTR5A, FAAH2, HRH1 TDP1 2360/4885TSHR 4233/4885CA1 3847/4885

“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.