SCHEMBL3673217

SCHEMBL3673217

CCOC(C)OCCC=CC=O

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.46
TRPA1 O75762 1/20 0.38
ALDH1A1 P00352 1/20 0.34
TSHR P16473 1/20 0.34

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
SCHEMBL3673215 1.00 LMNA (0.46) LMNATRPA1ALDH1A1TSHR
SCHEMBL466249 0.86 LMNA (0.48) LMNATRPA1ALDH1A1TSHR
SCHEMBL1200514 0.81 TSHR (0.58) LMNAALDH1A1TSHR
SCHEMBL9261863 0.81 LMNA (0.63) LMNATRPA1ALDH1A1TSHR
SCHEMBL9254529 0.81 LMNA (0.63) LMNATRPA1ALDH1A1TSHR
SCHEMBL872892 0.78 LMNA (0.52) LMNA
SCHEMBL1532435 0.78 LMNA (0.52) LMNA
SCHEMBL872893 0.78 LMNA (0.52) LMNA
Propylene Glycol SCHEMBL873638 0.78 LMNA (0.39) LMNATRPA1ALDH1A1TSHR
SCHEMBL4293299 0.76 LMNA (0.71) LMNAALDH1A1

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
US-7834220-B2 5,5-Diethoxy-(Z3)-3-Pentenyl Methoxymethyl Ether and Preparation Method Thereof SHIN-ETSU CHEMICAL CO., LTD. (JP) 2010-11-16 US disclosed
US-20100069664-A1 METHOD FOR PREPARING (E3,Z5)-3,5-ALKADIENYL ACETATE SHIN-ETSU CHEMICAL CO., LTD. 2010-03-18 US disclosed
US-7638647-B2 Method for preparing (E3,Z5)-3,5-alkadienyl acetate SHIN-ETSU CHEMICAL CO., LTD. (JP) 2009-12-29 US disclosed
US-20090143617-A1 METHOD FOR PREPARING (E3, Z5) -3,5-ALKADIENYL ACETATE SHIN-ETSU CHEMICAL CO. LTD. 2009-06-04 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 (2 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-20100069664-A1 METHOD FOR PREPARING (E3,Z5)-3,5-ALKADIENYL ACETATE APEH, DPP3, LAP3 LMNA 2202/4885TRPA1 2967/4885ALDH1A1 553/4885
US-20090143617-A1 METHOD FOR PREPARING (E3, Z5) -3,5-ALKADIENYL ACETATE APEH, DPP3, LAP3 LMNA 2202/4885TRPA1 2967/4885ALDH1A1 553/4885

“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.