SCHEMBL6060342

SCHEMBL6060342

CCCCCCC(=O)/C=C/C(C)=O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.61
POLA1 P09884 1/20 0.61
TRPA1 O75762 1/20 0.59
PPARG P37231 8/20 0.55
PPARA Q07869 8/20 0.55
KDM4E B2RXH2 1/20 0.54
CES2 O00748 3/20 0.50
CES1 P23141 3/20 0.50
HSP90AA1 P07900 1/20 0.48
GPR84 Q9NQS5 6/20 0.48
PPARD Q03181 6/20 0.48
HDAC11 Q96DB2 5/20 0.48
TSHR P16473 4/20 0.48
ALDH1A1 P00352 2/20 0.48
TLR2 O60603 2/20 0.48
TDP1 Q9NUW8 2/20 0.48
FABP4 P15090 2/20 0.48
PTPN1 P18031 2/20 0.48
SLC22A6 Q4U2R8 1/20 0.48
SLC22A8 Q8TCC7 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
SCHEMBL2600386 0.98 TRPA1 (0.61) POLBPOLA1TRPA1PPARGPPARA
SCHEMBL12833372 0.98 TRPA1 (0.61) POLBPOLA1TRPA1PPARGPPARA
SCHEMBL2081595 0.91 TRPA1 (0.52) POLBPOLA1TRPA1PPARGPPARA
SCHEMBL2081591 0.91 TRPA1 (0.52) POLBPOLA1TRPA1PPARGPPARA
SCHEMBL10808215 0.91 POLB (0.70) POLBPOLA1TRPA1PPARGPPARA
SCHEMBL30705405 0.91 POLB (0.70) POLBPOLA1TRPA1PPARGPPARA
SCHEMBL10808210 0.91 POLB (0.70) POLBPOLA1TRPA1PPARGPPARA
SCHEMBL30705404 0.91 POLB (0.70) POLBPOLA1TRPA1PPARGPPARA
SCHEMBL4451407 0.83 POLB (0.61) POLBPOLA1TRPA1PPARGPPARA
SCHEMBL8985149 0.83 POLB (0.61) POLBPOLA1TRPA1PPARGPPARA

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
EP-1321508-B1 Fragrance composition containing 3-(3-Hexenyl)-2-cyclopentenone TAKASAGO PERFUMERY CO LTD (JP) 2006-03-08 EP disclosed
US-6903067-B2 Fragrance composition containing 3-(3-hexenyl)-2-cyclopentenone TAKASAGO INTERNATIONAL CORPORATION (JP) 2005-06-07 US disclosed
US-20030158080-A1 Fragrance composition containing 3-(3-hexenyl)-2-cyclopentenone TAKASAGO INTERNATIONAL CORPORATION (JP) 2003-08-21 US disclosed
EP-1321508-A2 Fragrance composition containing 3-(3-Hexenyl)-2-cyclopentenone Takasago International Corporation (JP) 2003-06-25 EP 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-20030158080-A1 Fragrance composition containing 3-(3-hexenyl)-2-cyclopentenone WHR1, FASN, FADS2 POLB 2574/4885POLA1 1671/4885TRPA1 14/4885

“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.