SCHEMBL1617843

SCHEMBL1617843

CC(C)C1C(C)CCCC1OCCOCCCCO

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.32
THRB P10828 1/20 0.32
HTT P42858 1/20 0.32
KMT2A Q03164 1/20 0.32
MAPT P10636 1/20 0.32
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL1616053 0.95 ALDH1A1 (0.31) ALDH1A1
SCHEMBL1481588 0.92 KDM4E (0.34) ALDH1A1
SCHEMBL1617567 0.91 MEN1 (0.34) MEN1THRBHTTKMT2AMAPT
SCHEMBL584337 0.88 ALDH1A1 (0.33) ALDH1A1
SCHEMBL1617229 0.87 MEN1 (0.33) MEN1THRBHTTKMT2AMAPT
SCHEMBL1617233 0.87 POLB (0.31)
SCHEMBL1617808 0.87 EPHX2 (0.30)
SCHEMBL1617165 0.87
SCHEMBL1617140 0.85 EPHX2 (0.31)
SCHEMBL1616387 0.85 SPHK2 (0.32)

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-7923585-B2 Menthol derivative and cooling agent composition comprising the same TAKASAGO INTERNATIONAL CORPORATION (JP) 2011-04-12 US disclosed
US-20070225378-A1 Menthol Dearivative and Cooling Agent Composition Comprising the Same TAKASAGO INTERNATIONAL CORPORATION (JP) 2007-09-27 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-20070225378-A1 Menthol Dearivative and Cooling Agent Composition Comprising the Same TRPM7, TRPA1, TRPM2 MEN1 1342/4885THRB 3079/4885HTT 3614/4885

“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.