SCHEMBL1782449

SCHEMBL1782449

CCCCCC(C)C(C)C(C)=O

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.48
FAAH O00519 1/20 0.44
ACE2 Q9BYF1 1/20 0.44
GPR84 Q9NQS5 7/20 0.43
FFAR1 O14842 1/20 0.43
MAPT P10636 1/20 0.42
TP53 P04637 1/20 0.42
LCK P06239 1/20 0.42
PPARD Q03181 1/20 0.42
ZDHHC20 Q5W0Z9 1/20 0.42
ZDHHC2 Q9UIJ5 1/20 0.42
OPRM1 P35372 1/20 0.41
CA2 P00918 1/20 0.41
FDPS P14324 1/20 0.40
SMPD1 P17405 1/20 0.39

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
SCHEMBL1783613 0.93 CA2 (0.41) CA1FAAHACE2GPR84CA2
SCHEMBL1782548 0.83 METAP1 (0.41) CA1FAAHFDPS
SCHEMBL544448 0.82 GPR84 (0.54) CA1ACE2GPR84FFAR1MAPT
SCHEMBL18311500 0.82 GPR84 (0.54) CA1ACE2GPR84FFAR1MAPT
SCHEMBL1782202 0.80 GPR84 (0.47) CA1FAAHACE2GPR84FFAR1
SCHEMBL431797 0.80 CA2 (0.39) CA1FAAHACE2GPR84CA2
SCHEMBL994542 0.80 GPR84 (0.57) CA1FAAHACE2GPR84FFAR1
SCHEMBL4054463 0.80 SPHK1 (0.52) CA1FAAHGPR84FFAR1MAPT
SCHEMBL574523 0.80 GPR84 (0.57) CA1FAAHACE2GPR84FFAR1
SCHEMBL1115823 0.80 GPR84 (0.57) CA1FAAHACE2GPR84FFAR1

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 CA1 3505/4885FAAH 94/4885ACE2 4401/4885

“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.