SCHEMBL1658296

SCHEMBL1658296

CCCCC(C)(C)CCCCO

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.55
LMNA P02545 2/20 0.52
ALDH1A1 P00352 2/20 0.52
TSHR P16473 2/20 0.52
HSD17B10 Q99714 1/20 0.52
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
CYP4F2 P78329 2/20 0.41
CYP4A11 Q02928 2/20 0.41
FFAR1 O14842 1/20 0.36
CPT2 P23786 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
FDPS P14324 7/20 0.33
GGPS1 O95749 4/20 0.33

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
SCHEMBL588498 0.97 LMNA (0.57) SMN1; SMN2LMNAALDH1A1TSHRHSD17B10
SCHEMBL1658861 0.97 SMN1; SMN2 (0.58) SMN1; SMN2LMNAALDH1A1TSHRHSD17B10
SCHEMBL1657812 0.95 SMN1; SMN2 (0.63) SMN1; SMN2LMNAALDH1A1TSHRHSD17B10
SCHEMBL31339077 0.92 LMNA (0.65) SMN1; SMN2LMNAALDH1A1TSHRHSD17B10
SCHEMBL20026795 0.90 LMNA (0.62) SMN1; SMN2LMNAALDH1A1TSHRHSD17B10
SCHEMBL1659019 0.90 SMN1; SMN2 (0.48) SMN1; SMN2LMNAALDH1A1TSHRHSD17B10
SCHEMBL6448246 0.89 SMN1; SMN2 (0.42) SMN1; SMN2LMNAALDH1A1TSHRHSD17B10
SCHEMBL1658863 0.87 LMNA (0.50) SMN1; SMN2LMNAALDH1A1TSHRHSD17B10
SCHEMBL1658327 0.86 SMN1; SMN2 (0.50) SMN1; SMN2LMNAALDH1A1TSHRHSD17B10
SCHEMBL1657973 0.86 ALDH1A1 (0.45) SMN1; SMN2LMNAALDH1A1TSHRHSD17B10

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 6 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-20130131169-A1 COOLING SENSATION AGENT COMPOSITION, SENSORY STIMULATION AGENT COMPOSITION AND USE OF THE SAME TAKASAGO INTERNATIONAL CORPORATION (JP) 2013-05-23 US disclosed
US-8377458-B2 Cooling sensation agent composition, sensory stimulation agent composition and use of the same TAKASAGO INTERNATIONAL CORPORATION (JP) 2013-02-19 US disclosed
US-20110117147-A1 COOLING SENSATION AGENT COMPOSITION AND SENSORY STIMULATION AGENT COMPOSITION TAKASAGO INTERNATIONAL CORPORATION (JP) 2011-05-19 US disclosed
US-20110081393-A1 COOLING SENSATION AGENT COMPOSITION, SENSORY STIMULATION AGENT COMPOSITION AND USE OF THE SAME TAKASAGO INTERNATIONAL CORPORATION 2011-04-07 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 (3 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 SMN1; SMN2 2144/4885LMNA 1708/4885ALDH1A1 520/4885
US-20110081393-A1 COOLING SENSATION AGENT COMPOSITION, SENSORY STIMULATION AGENT COMPOSITION AND USE OF THE SAME TRPA1, TRPV1, TRPM4 SMN1; SMN2 2797/4885LMNA 1727/4885ALDH1A1 685/4885
US-20130131169-A1 COOLING SENSATION AGENT COMPOSITION, SENSORY STIMULATION AGENT COMPOSITION AND USE OF THE SAME TRPA1, TRPV1, TRPM4 SMN1; SMN2 2797/4885LMNA 1727/4885ALDH1A1 685/4885

“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.