SCHEMBL4938624

SCHEMBL4938624

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

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.46
▸ ALDH1A1 P00352 1/20 0.41
▸ TERT O14746 3/20 0.38
▸ PTPN1 P18031 3/20 0.38
▸ PPARG P37231 3/20 0.38
▸ PPARD Q03181 3/20 0.38
▸ PPARA Q07869 3/20 0.38
▸ CYP1A2 P05177 2/20 0.38
▸ CYP2C19 P33261 2/20 0.38
▸ BLM P54132 2/20 0.38
▸ HSD17B10 Q99714 2/20 0.38
▸ FABP4 P15090 2/20 0.38
▸ F7 P08709 2/20 0.38
▸ F3 P13726 2/20 0.38
▸ FAAH O00519 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ GMNN O75496 1/20 0.38
▸ USP2 O75604 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ POLB P06746 1/20 0.38

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
SCHEMBL4582243 1.00 MAPT (0.46) MAPTALDH1A1TERTPTPN1PPARG
SCHEMBL4939527 0.96 MAPT (0.42) MAPTTERTPTPN1PPARGPPARD
SCHEMBL4582615 0.96 MAPT (0.42) MAPTTERTPTPN1PPARGPPARD
SCHEMBL4939335 0.95 FAAH (0.44) MAPTTERTPTPN1PPARGPPARD
SCHEMBL4583192 0.95 FAAH (0.44) MAPTTERTPTPN1PPARGPPARD
SCHEMBL9859616 0.93 MAPT (0.39) MAPTALDH1A1PPARGPPARAATM
SCHEMBL9859623 0.93 MAPT (0.39) MAPTALDH1A1PPARGPPARAATM
SCHEMBL4939554 0.89 MAPT (0.46) MAPTALDH1A1PPARGPPARDPPARA
SCHEMBL4582766 0.89 MAPT (0.46) MAPTALDH1A1PPARGPPARDPPARA
SCHEMBL1883791 0.89 MAPT (0.44) MAPTALDH1A1TERTPTPN1PPARG

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 4488/4885ALDH1A1 21/4885TERT 1543/4885

“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.

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