SCHEMBL1301754

SCHEMBL1301754

CCCCCC(CCC(C)CCC)OC(C)=O

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ACE2 Q9BYF1 1/20 0.47
GLS2 Q9UI32 3/20 0.42
PRKCA P17252 2/20 0.42
FAAH O00519 5/20 0.41
CNR1 P21554 1/20 0.40
CNR2 P34972 1/20 0.40
CA1 P00915 2/20 0.39
LTA4H P09960 1/20 0.38
LMNA P02545 2/20 0.37
PDCD4 Q53EL6 1/20 0.37

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
SCHEMBL1302366 0.98 ACE2 (0.50) ACE2GLS2PRKCAFAAHCNR1
SCHEMBL1301356 0.98 ACE2 (0.50) ACE2GLS2PRKCAFAAHCNR1
SCHEMBL1301856 0.91 TSHR (0.41) ACE2GLS2PRKCALMNA
SCHEMBL1301815 0.89 ACE2 (0.55) ACE2GLS2PRKCAFAAHCNR1
SCHEMBL1301058 0.89 TSHR (0.39) ACE2GLS2PRKCALMNA
SCHEMBL17676333 0.87 PRKCA (0.47) GLS2PRKCAFAAHCA1LTA4H
SCHEMBL24052687 0.87 PRKCA (0.50) GLS2PRKCAFAAHCA1LTA4H
SCHEMBL7208132 0.85 PRKCA (0.50) GLS2PRKCAFAAH
SCHEMBL7192323 0.85 PRKCA (0.50) GLS2PRKCAFAAH
SCHEMBL15674731 0.85 PRKCA (0.50) GLS2PRKCAFAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110266361-A1 PHEROMONE DISPENSER BASF SE (DE) 2011-11-03 US disclosed