SCHEMBL466249

SCHEMBL466249

CCC/C=C/C=O.CCOC(C)OCC

nearest known ligand 0.48

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.48
ALDH1A1 P00352 2/20 0.39
TSHR P16473 1/20 0.39
TRPA1 O75762 1/20 0.39

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
Propylene Glycol SCHEMBL873638 0.90 LMNA (0.39) LMNAALDH1A1TSHRTRPA1
SCHEMBL1200514 0.87 TSHR (0.58) LMNAALDH1A1TSHR
SCHEMBL3673217 0.86 LMNA (0.46) LMNAALDH1A1TSHRTRPA1
SCHEMBL3673215 0.86 LMNA (0.46) LMNAALDH1A1TSHRTRPA1
SCHEMBL9261863 0.83 LMNA (0.63) LMNAALDH1A1TSHRTRPA1
SCHEMBL9254529 0.83 LMNA (0.63) LMNAALDH1A1TSHRTRPA1
SCHEMBL8214277 0.80 TRPA1 (0.58) ALDH1A1TSHRTRPA1
SCHEMBL112269 0.80
SCHEMBL1701371 0.80
SCHEMBL29822 0.80

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-2405746-A2 COMPOSITION FOR ATTRACTING BED BUGS FMC Corporation (US) 2012-01-18 EP disclosed
US-20110044936-A1 Composition for Attracting Bed Bugs FMC CORPORATION 2011-02-24 US disclosed
WO-2010105029-A2 COMPOSITION FOR ATTRACTING BED BUGS FMC CORPORATION (US) 2010-09-16 WO disclosed