SCHEMBL14670792

SCHEMBL14670792

CCOC(C)OCCCCCCCCC=O

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.46
TSHR P16473 2/20 0.45
FAAH O00519 2/20 0.41
TRPV1 Q8NER1 2/20 0.41
MAPT P10636 1/20 0.33
HIF1A Q16665 1/20 0.33
ALDH1A1 P00352 2/20 0.31
CNR1 P21554 1/20 0.31
CNR2 P34972 1/20 0.31

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
Heptanal SCHEMBL1664616 0.86 TSHR (0.64) LMNATSHRFAAHTRPV1ALDH1A1
Decanal SCHEMBL597465 0.86 TSHR (0.64) LMNATSHRFAAHTRPV1ALDH1A1
Decanal SCHEMBL6949312 0.86 TSHR (0.64) LMNATSHRFAAHTRPV1ALDH1A1
Decanal SCHEMBL598213 0.86 TSHR (0.64) LMNATSHRFAAHTRPV1ALDH1A1
Glutaral SCHEMBL7174412 0.86 LMNA (0.57) LMNATSHRFAAHTRPV1MAPT
Hexanal SCHEMBL10352184 0.84 TSHR (0.60) LMNATSHRFAAHTRPV1MAPT
Decanal SCHEMBL5144514 0.83 TSHR (0.59) LMNATSHRFAAHTRPV1ALDH1A1
Glutaral SCHEMBL7886922 0.82 LMNA (0.52) LMNATSHRFAAHTRPV1MAPT
Glutaral SCHEMBL6229345 0.82 LMNA (0.52) LMNATSHRFAAHTRPV1MAPT
Glutaral SCHEMBL5734852 0.82 LMNA (0.52) LMNATSHRFAAHTRPV1MAPT

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
EP-3061345-A1 SEX PHEROMONE DERIVATIVES, AND METHODS AND USES THEREOF Her Majesty the Queen in Right of Canada, as represented by the Minister of Natural Resources Canada (CA) 2016-08-31 EP disclosed
US-9226503-B2 Composition and method for attraction of emerald ash borer Agrilus planipennis fairmaire (coleoptera: buprestidae) HER MAJESTY THE QUEEN, IN RIGHT OF CANADA, AS REPRESENTED BY THE MINISTER OF NATURAL RESOURCES CANADA (CA) 2016-01-05 US disclosed
US-20150132252-A1 Composition and Method for Attraction of Emerald Ash Borer Agrilus Planipennis Fairmaire (Coleoptera: Buprestidae) HER MAJESTY THE QUEEN IN RIGHT OF CANADA, AS REPRESENTED BY THE MINISTER OF NATURAL RESOURCES (CA) 2015-05-14 US disclosed
US-20130028858-A1 COMPOSITION AND METHOD FOR ATTRACTION OF EMERALD ASH BORER AGRILUS PLANIPENNIS FAIRMAIRE (COLEOPTERA: BUPRESTIDAE) NATIONAL RESEARCH COUNCIL OF CANADA (CA) 2013-01-31 US disclosed