SCHEMBL1786687

SCHEMBL1786687

CCCCC(C)(O)CC=O

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.40
FDPS P14324 10/20 0.35
GGPS1 O95749 6/20 0.35
TRPV1 Q8NER1 1/20 0.33
FAAH O00519 1/20 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
SCHEMBL1782419 0.93 FDPS (0.43) TSHRFDPSGGPS1TRPV1
SCHEMBL1783830 0.91 FDPS (0.45) TSHRFDPSGGPS1TRPV1FAAH
SCHEMBL1782782 0.91 FDPS (0.45) TSHRFDPSGGPS1TRPV1FAAH
SCHEMBL1781487 0.85
Acetaldehyde SCHEMBL27379849 0.79 FDPS (0.34) TSHRFDPSGGPS1
SCHEMBL3487755 0.79
SCHEMBL808879 0.79 ALDH1A1 (0.39) TSHRFDPSGGPS1
SCHEMBL1782657 0.79 FDPS (0.31) TSHRFDPSGGPS1
SCHEMBL1783235 0.79 ALDH1A1 (0.39) TSHRFDPSGGPS1
SCHEMBL1782659 0.79 FDPS (0.31) TSHRFDPSGGPS1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113891882-A Method for producing dihydroisoxazole 组合化学工业株式会社 2022-01-04 CN disclosed
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 TSHR 2479/4885FDPS 3227/4885GGPS1 647/4885

“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.