SCHEMBL8401705

SCHEMBL8401705

C=CC1OCCO1.CCOC(C)OCC

nearest known ligand 0.46

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.46

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
SCHEMBL7590839 0.75 LMNA (0.55) LMNA
SCHEMBL19523376 0.73 TDP1 (0.42)
SCHEMBL305072 0.73
Butadiene SCHEMBL625826 0.71 LMNA (0.71) LMNA
Propene SCHEMBL560443 0.71 LMNA (0.71) LMNA
Fluoride SCHEMBL6012729 0.71
Allyl Alcohol SCHEMBL11589296 0.70 LMNA (0.60) LMNA
SCHEMBL7592942 0.70
Dioxane SCHEMBL7672675 0.69 LMNA (0.67) LMNA
Vinyl Chloride SCHEMBL4142982 0.69 LMNA (0.67) LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0793417-B1 ACROLEIN-RELEASING COMPOSITION AND USE THEREOF DEGUSSA (DE) 1999-06-09 EP disclosed
EP-0793417-A1 ACROLEIN-RELEASING COMPOSITION AND USE THEREOF Degussa Aktiengesellschaft (DE) 1997-09-10 EP disclosed
WO-1996015668-A1 ACROLEIN-RELEASING COMPOSITION AND USE THEREOF DEGUSSA AKTIENGESELLSCHAFT (DE) 1996-05-30 WO disclosed