SCHEMBL1785734

SCHEMBL1785734

CCCC(C)(OC)C(C)=O

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.48
LMNA P02545 1/20 0.38
HSD17B10 Q99714 1/20 0.38
ELANE P08246 1/20 0.34
ALDH1A1 P00352 3/20 0.33
TSHR P16473 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
FDPS P14324 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
SCHEMBL1781190 0.86 GAA (0.45) GAALMNAELANEALDH1A1TSHR
SCHEMBL1782466 0.85 GAA (0.43) GAAALDH1A1FDPS
SCHEMBL1782211 0.83 GAA (0.42) GAAALDH1A1FDPS
SCHEMBL7031959 0.81 LMNA (0.38) GAALMNAHSD17B10ELANEALDH1A1
SCHEMBL1739828 0.81 LMNA (0.38) GAALMNAHSD17B10ELANEALDH1A1
SCHEMBL13688674 0.80
SCHEMBL7026227 0.79 ELANE (0.37) GAALMNAHSD17B10ELANEALDH1A1
SCHEMBL7022620 0.79 ELANE (0.37) GAALMNAHSD17B10ELANEALDH1A1
SCHEMBL1783491 0.77 LMNA (0.32) GAALMNAHSD17B10ELANE
SCHEMBL1783490 0.77 LMNA (0.32) GAALMNAHSD17B10ELANE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3019196-B1 COMBINATIONS OF HEPATITIS C VIRUS INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2018-06-06 EP disclosed
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 GAA 4800/4885LMNA 1708/4885HSD17B10 2048/4885

“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.