SCHEMBL1784356

SCHEMBL1784356

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

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.36
ASAH2 Q9NR71 1/20 0.32
TAS1R3 Q7RTX0 1/20 0.32
TAS1R1 Q7RTX1 1/20 0.32
MAPT P10636 3/20 0.31
FFAR1 O14842 1/20 0.31
CYP19A1 P11511 1/20 0.31
RXRA P19793 1/20 0.31
PPARG P37231 1/20 0.31
OXER1 Q8TDS5 1/20 0.31
TDP1 Q9NUW8 2/20 0.31
LMNA P02545 2/20 0.31
SLC15A2 Q16348 1/20 0.31
GAPDH P04406 1/20 0.30
USP2 O75604 1/20 0.30
CYP3A4 P08684 1/20 0.30
RECQL P46063 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HDAC2 Q92769 1/20 0.30
CNR2 P34972 2/20 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
SCHEMBL1784355 1.00 ALDH1A1 (0.36) ALDH1A1ASAH2TAS1R3TAS1R1MAPT
SCHEMBL1784893 0.86 ALDH1A1 (0.35) ALDH1A1ASAH2TAS1R3TAS1R1MAPT
SCHEMBL1784896 0.86 ALDH1A1 (0.35) ALDH1A1ASAH2TAS1R3TAS1R1MAPT
SCHEMBL9356092 0.79
SCHEMBL1783300 0.77 ALDH1A1 (0.38) ALDH1A1MAPTTDP1LMNASLC15A2
SCHEMBL1783302 0.77 ALDH1A1 (0.38) ALDH1A1MAPTTDP1LMNASLC15A2
SCHEMBL13937926 0.76 TAS1R3 (0.41) ALDH1A1ASAH2TAS1R3TAS1R1MAPT
SCHEMBL22931171 0.76
SCHEMBL18597174 0.76 PRKCA (0.32) ALDH1A1MAPTLMNAUSP2CYP3A4
SCHEMBL1786269 0.76 ALDH1A1 (0.46) ALDH1A1TDP1GAPDH

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 ALDH1A1 520/4885ASAH2 3846/4885TAS1R3 65/4885

“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.