SCHEMBL1783436

SCHEMBL1783436

CC(=O)CCC(C)CC(C)C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.43
TDP1 Q9NUW8 1/20 0.42
CA1 P00915 2/20 0.37
LMNA P02545 1/20 0.36
SLC15A2 Q16348 1/20 0.36
RNPEP Q9H4A4 1/20 0.36
SLC7A5 Q01650 1/20 0.36
KISS1R Q969F8 3/20 0.35
FOLH1 Q04609 2/20 0.33
PTGES O14684 1/20 0.32
ALOX5 P09917 1/20 0.32
KDM1A O60341 1/20 0.32
CACNA2D1 P54289 2/20 0.31
CACNB3 P54284 1/20 0.31
CACNA1C Q13936 1/20 0.31
PGR P06401 1/20 0.31
ADRA1A P35348 1/20 0.31
HTR2B P41595 1/20 0.31
CACNA2D2 Q9NY47 1/20 0.31
BLM P54132 1/20 0.31

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
SCHEMBL1783088 0.86 ALDH1A1 (0.39) ALDH1A1TDP1CA1LMNASLC15A2
SCHEMBL15821253 0.82 PAOX (0.45) ALDH1A1TDP1LMNAKISS1RBLM
SCHEMBL9051529 0.82 PAOX (0.45) ALDH1A1TDP1LMNAKISS1RBLM
SCHEMBL15821251 0.82 PAOX (0.45) ALDH1A1TDP1LMNAKISS1RBLM
SCHEMBL1783656 0.81 ALDH1A1 (0.39) ALDH1A1TDP1CA1LMNASLC15A2
SCHEMBL759816 0.80 GABRP (0.52) RNPEPSLC7A5FOLH1
SCHEMBL5532774 0.80 GABRP (0.52) RNPEPSLC7A5FOLH1
SCHEMBL20489972 0.80 CA1 (0.37) ALDH1A1TDP1CA1RNPEPSLC7A5
SCHEMBL1783682 0.80 ALDH1A1 (0.43) ALDH1A1TDP1CA1LMNASLC15A2
SCHEMBL7541851 0.78

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 5 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-8361753-B2 Phosphotriester-modified oligonucleotide primers for nucleic acid amplification TRILINK BIOTECHNOLOGIES, INC. (US) 2013-01-29 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
US-20070281308-A1 CHEMICALLY MODIFIED OLIGONUCLEOTIDE PRIMERS FOR NUCLEIC ACID AMPLIFICATION TRILINK BIOTECHNOLOGIES, LLC 2007-12-06 US 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 (2 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-20070281308-A1 CHEMICALLY MODIFIED OLIGONUCLEOTIDE PRIMERS FOR NUCLEIC ACID AMPLIFICATION POLRMT, POLI, POLM ALDH1A1 384/4885TDP1 389/4885CA1 494/4885
US-20110117147-A1 COOLING SENSATION AGENT COMPOSITION AND SENSORY STIMULATION AGENT COMPOSITION TRPA1, HRH1, HRH2 ALDH1A1 520/4885TDP1 3995/4885CA1 3505/4885

“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.