SCHEMBL1784900

SCHEMBL1784900

CCCCC(O)C(C)=C(C)C(C)=O

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 3/20 0.47
FFAR1 O14842 1/20 0.47
ACHE P22303 1/20 0.39
BACE1 P56817 1/20 0.39
CA2 P00918 3/20 0.39
MAPK1 P28482 1/20 0.39
CES1 P23141 1/20 0.38
CA1 P00915 1/20 0.38
FDPS P14324 1/20 0.35

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
SCHEMBL1784899 1.00 GPR84 (0.47) GPR84FFAR1ACHEBACE1CA2
SCHEMBL1781776 0.86 CHRM1 (0.37) GPR84FFAR1CES1FDPS
SCHEMBL1781775 0.86 CHRM1 (0.37) GPR84FFAR1CES1FDPS
SCHEMBL27601392 0.77 GPR84 (0.50) GPR84FFAR1ACHEBACE1CA2
SCHEMBL7595851 0.77
SCHEMBL105176 0.77
SCHEMBL18610931 0.77
SCHEMBL1786823 0.77 TSHR (0.33)
SCHEMBL1786824 0.77 TSHR (0.33)
SCHEMBL533291 0.74 GPR84 (0.56) GPR84FFAR1CA2MAPK1CA1

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 GPR84 77/4885FFAR1 229/4885ACHE 1079/4885

“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.