SCHEMBL1784484

SCHEMBL1784484

CC(C)C(C)CCCCC=O

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.44
HIF1A Q16665 1/20 0.43
FAAH O00519 2/20 0.39
TRPV1 Q8NER1 2/20 0.39
ALDH1A1 P00352 1/20 0.33
ADH1B P00325 1/20 0.30
ADH1C P00326 1/20 0.30
ADH1A P07327 1/20 0.30
ADH4 P08319 1/20 0.30
ADH7 P40394 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
SCHEMBL1781622 0.98 TSHR (0.48) TSHRHIF1AFAAHTRPV1ALDH1A1
SCHEMBL10629761 0.98 TSHR (0.48) TSHRHIF1AFAAHTRPV1ALDH1A1
SCHEMBL1784414 0.92 HIF1A (0.45) TSHRHIF1AFAAHTRPV1ALDH1A1
SCHEMBL1783577 0.81
SCHEMBL1783246 0.81 TSHR (0.46) TSHRHIF1AFAAHTRPV1ALDH1A1
SCHEMBL10081315 0.79 TSHR (0.48) TSHRHIF1AFAAHTRPV1ALDH1A1
SCHEMBL1409410 0.79
SCHEMBL23644661 0.77
SCHEMBL15327039 0.77 TSHR (0.52) TSHRHIF1AFAAHTRPV1ALDH1A1
SCHEMBL443450 0.77 TSHR (0.52) TSHRHIF1AFAAHTRPV1ALDH1A1

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-8632792-B2 Cooling sensation agent composition and sensory stimulation agent composition TAKASAGO INTERNATIONAL CORPORATION (JP) 2014-01-21 US disclosed
US-20110117147-A1 COOLING SENSATION AGENT COMPOSITION AND SENSORY STIMULATION AGENT COMPOSITION TAKASAGO INTERNATIONAL CORPORATION (JP) 2011-05-19 US disclosed
WO-2009123355-A2 COOLING SENSATION AGENT COMPOSITION AND SENSORY STIMULATION AGENT COMPOSITION TAKASAGO INTERNATIONAL CORPORATION (JP) 2009-10-08 WO 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-20110117147-A1 COOLING SENSATION AGENT COMPOSITION AND SENSORY STIMULATION AGENT COMPOSITION TRPA1, HRH1, HRH2 TSHR 2479/4885HIF1A 1980/4885FAAH 94/4885

“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.