SCHEMBL1782167

SCHEMBL1782167

CCC(C)CCCC(O)C(C)C=O

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
SPHK1 Q9NYA1 1/20 0.31
TRPV1 Q8NER1 1/20 0.31
TRPA1 O75762 1/20 0.31
BLM P54132 1/20 0.31
PTPN1 P18031 1/20 0.30
CTSK P43235 1/20 0.30
LMNA P02545 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
SCHEMBL1784469 0.88 TSHR (0.32) TSHRSMN1; SMN2PTPN1
SCHEMBL1783970 0.81 LMNA (0.39) SPHK1TRPV1TRPA1BLMPTPN1
SCHEMBL11179784 0.81 TSHR (0.46) TSHRSMN1; SMN2SPHK1TRPA1BLM
SCHEMBL1783784 0.81 TSHR (0.46) TSHRSMN1; SMN2SPHK1TRPA1BLM
SCHEMBL1786274 0.79 SPHK1 (0.52) TSHRSMN1; SMN2SPHK1TRPA1BLM
SCHEMBL1781451 0.78 SPHK1 (0.55) SPHK1TRPV1TRPA1BLMLMNA
SCHEMBL1783266 0.78 SPHK1 (0.55) SPHK1TRPV1TRPA1BLMLMNA
SCHEMBL1784709 0.77 TRPA1 (0.39) SPHK1TRPV1TRPA1BLMLMNA
SCHEMBL1784659 0.77 PTPN1 (0.39) TSHRPTPN1
SCHEMBL5499873 0.76

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 2479/4885SMN1; SMN2 2144/4885SPHK1 1693/4885

“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.