SCHEMBL1658545

SCHEMBL1658545

CCCCCCCCC=CCCC(C)O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 4/20 0.53
KMT2A Q03164 3/20 0.53
MEN1 O00255 2/20 0.53
CYP3A4 P08684 2/20 0.53
SOAT1 P35610 2/20 0.53
CYP1A2 P05177 2/20 0.53
CYP2C19 P33261 2/20 0.53
TP53 P04637 1/20 0.53
TRPV1 Q8NER1 1/20 0.50
KDM4E B2RXH2 2/20 0.48
TERT O14746 3/20 0.48
PTPN1 P18031 3/20 0.48
MAPT P10636 2/20 0.48
BLM P54132 2/20 0.48
HSD17B10 Q99714 2/20 0.48
FABP4 P15090 2/20 0.48
PPARG P37231 2/20 0.48
PPARD Q03181 2/20 0.48
PPARA Q07869 2/20 0.48
GMNN O75496 1/20 0.48

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
SCHEMBL1658543 1.00 FAAH (0.53) FAAHKMT2AMEN1CYP3A4SOAT1
SCHEMBL31650568 0.98 FAAH (0.50) FAAHKMT2AMEN1CYP3A4SOAT1
SCHEMBL1657168 0.98 FAAH (0.50) FAAHKMT2AMEN1CYP3A4SOAT1
SCHEMBL31650510 0.98 FAAH (0.50) FAAHKMT2AMEN1CYP3A4SOAT1
SCHEMBL1657170 0.98 FAAH (0.50) FAAHKMT2AMEN1CYP3A4SOAT1
SCHEMBL6439344 0.96 FAAH (0.48) FAAHKMT2AMEN1CYP3A4SOAT1
SCHEMBL14024787 0.94 KDM4E (0.58) CYP3A4SOAT1KDM4EHSD17B10FABP4
SCHEMBL25829500 0.92 CNR1 (0.56) SOAT1TRPV1KDM4EPPARG
SCHEMBL6444180 0.92 ALDH1A1 (0.53) FAAHKMT2AMEN1CYP3A4SOAT1
SCHEMBL811313 0.91 FAAH (0.53) FAAHKMT2AMEN1CYP3A4SOAT1

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 FAAH 94/4885KMT2A 3562/4885MEN1 251/4885
US-20110081393-A1 COOLING SENSATION AGENT COMPOSITION, SENSORY STIMULATION AGENT COMPOSITION AND USE OF THE SAME TRPA1, TRPV1, TRPM4 FAAH 13/4885KMT2A 3700/4885MEN1 458/4885
US-20130131169-A1 COOLING SENSATION AGENT COMPOSITION, SENSORY STIMULATION AGENT COMPOSITION AND USE OF THE SAME TRPA1, TRPV1, TRPM4 FAAH 13/4885KMT2A 3700/4885MEN1 458/4885

“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.