SCHEMBL1783970

SCHEMBL1783970

CC(C)CCCC(O)C(C)C=O

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.39
BLM P54132 1/20 0.38
TRPV1 Q8NER1 1/20 0.34
TRPA1 O75762 1/20 0.34
PTPN1 P18031 2/20 0.33
MEN1 O00255 1/20 0.33
CYP3A4 P08684 1/20 0.33
ALOX15 P16050 1/20 0.33
KMT2A Q03164 1/20 0.33
SPHK1 Q9NYA1 1/20 0.30
KDM1A O60341 1/20 0.30
CA1 P00915 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
SCHEMBL1784709 0.95 TRPA1 (0.39) LMNABLMTRPV1TRPA1SPHK1
SCHEMBL1782339 0.86 CA1 (0.32) CA1
SCHEMBL11179784 0.82 TSHR (0.46) LMNABLMTRPA1CYP3A4SPHK1
SCHEMBL1783784 0.82 TSHR (0.46) LMNABLMTRPA1CYP3A4SPHK1
SCHEMBL1782167 0.81 TSHR (0.33) LMNABLMTRPV1TRPA1PTPN1
SCHEMBL1786274 0.80 SPHK1 (0.52) LMNABLMTRPA1CYP3A4SPHK1
SCHEMBL1783266 0.78 SPHK1 (0.55) LMNABLMTRPV1TRPA1CYP3A4
SCHEMBL1781451 0.78 SPHK1 (0.55) LMNABLMTRPV1TRPA1CYP3A4
SCHEMBL20820019 0.77 TRPV1 (0.40) TRPV1TRPA1SPHK1
SCHEMBL12895603 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 LMNA 1708/4885BLM 4418/4885TRPV1 8/4885

“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.