SCHEMBL4936586

SCHEMBL4936586

CCC/C=C/CCC/C=C/C(=O)OC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.50
HCAR2 Q8TDS4 2/20 0.46
KEAP1 Q14145 1/20 0.46
NFE2L2 Q16236 1/20 0.46
ALDH1A1 P00352 1/20 0.45
TAS1R3 Q7RTX0 1/20 0.42
TAS1R1 Q7RTX1 1/20 0.42
CNR1 P21554 2/20 0.40
CNR2 P34972 2/20 0.40
FAAH O00519 1/20 0.40
PSMB11 A5LHX3 1/20 0.40
PSMA7 O14818 1/20 0.40
PSMB1 P20618 1/20 0.40
PSMA1 P25786 1/20 0.40
PSMA2 P25787 1/20 0.40
PSMA3 P25788 1/20 0.40
PSMA4 P25789 1/20 0.40
PSMB8 P28062 1/20 0.40
PSMB9 P28065 1/20 0.40
PSMA5 P28066 1/20 0.40

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
SCHEMBL4584292 1.00 MAPT (0.50) MAPTHCAR2KEAP1NFE2L2ALDH1A1
SCHEMBL4582554 0.96 HCAR2 (0.46) MAPTHCAR2KEAP1NFE2L2TAS1R3
SCHEMBL4939935 0.96 HCAR2 (0.46) MAPTHCAR2KEAP1NFE2L2TAS1R3
SCHEMBL4937441 0.94 MAPT (0.44) MAPTHCAR2KEAP1NFE2L2FAAH
SCHEMBL4583174 0.94 MAPT (0.44) MAPTHCAR2KEAP1NFE2L2FAAH
SCHEMBL18120374 0.92
SCHEMBL873968 0.92
SCHEMBL873967 0.92
SCHEMBL29626505 0.89 HCAR2 (0.57) MAPTHCAR2KEAP1NFE2L2ALDH1A1
SCHEMBL11874324 0.88 KEAP1 (0.46) MAPTHCAR2KEAP1NFE2L2FAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080076699-A1 Deconjugated alkadienoic acid esters as fragrances and or aroma substances SYMRISE GMBH & CO. KG (DE) 2008-03-27 US claimed
US-20080076699-A1 Deconjugated alkadienoic acid esters as fragrances and or aroma substances SYMRISE GMBH & CO. KG (DE) 2008-03-27 US 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-20080076699-A1 Deconjugated alkadienoic acid esters as fragrances and or aroma substances DECR1, ALOX12, ALOX15 MAPT 4488/4885HCAR2 108/4885KEAP1 477/4885

“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.