SCHEMBL17060566

SCHEMBL17060566

N#Cc1cnc(C(O)C2CCc3cc(OCc4ccccc4)ccc3C2)o1

nearest known ligand 0.65

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
FAAH O00519 19/20 0.65
HRH3 Q9Y5N1 1/20 0.42

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
SCHEMBL17067927 0.88 FAAH (0.64) FAAH
SCHEMBL17067888 0.86 FAAH (0.64) FAAHHRH3
SCHEMBL17060573 0.85 FAAH (0.56) FAAHHRH3
SCHEMBL17067929 0.82 FAAH (0.66) FAAH
SCHEMBL17067912 0.82 FAAH (0.68) FAAH
SCHEMBL12472319 0.80 FAAH (0.62) FAAHHRH3
SCHEMBL17067917 0.79 FAAH (1.00) FAAH
SCHEMBL18264458 0.75 FAAH (0.72) FAAH
SCHEMBL12472374 0.75 FAAH (0.66) FAAH
SCHEMBL17067886 0.73 FAAH (0.54) FAAH

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
US-9504675-B2 Alpha-ketoheterocycles and methods of making and using THE SCRIPPS RESEARCH INSTITUTE (US) 2016-11-29 US disclosed
EP-2670245-B1 ALPHA-KETOHETEROCYCLES AND METHODS OF MAKING AND USING SCRIPPS RESEARCH INST (US) 2015-09-09 EP disclosed
EP-2670245-B1 ALPHA-KETOHETEROCYCLES AND METHODS OF MAKING AND USING SCRIPPS RESEARCH INST (US) 2015-09-09 EP disclosed