SCHEMBL9959150

SCHEMBL9959150

CCCCCCC(C)CC(=O)CBr

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FAAH O00519 5/20 0.54
CNR1 P21554 1/20 0.54
CNR2 P34972 1/20 0.54
ACE2 Q9BYF1 1/20 0.52
LCK P06239 1/20 0.46
PPARD Q03181 1/20 0.46
ZDHHC20 Q5W0Z9 1/20 0.46
ZDHHC2 Q9UIJ5 1/20 0.46
GPR84 Q9NQS5 7/20 0.44
FFAR1 O14842 1/20 0.42
CA1 P00915 1/20 0.42
ZDHHC7 Q9NXF8 1/20 0.42
ASAH1 Q13510 1/20 0.41
MAPT P10636 1/20 0.41

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
SCHEMBL28945753 0.88 ACE2 (0.59) ACE2LCKPPARDZDHHC20ZDHHC2
SCHEMBL28945792 0.88 ACE2 (0.59) ACE2LCKPPARDZDHHC20ZDHHC2
SCHEMBL28480389 0.86 ACE2 (0.55) ACE2LCKPPARDZDHHC20ZDHHC2
SCHEMBL807542 0.84 ACE2 (0.55) FAAHCNR1CNR2ACE2LCK
SCHEMBL9142345 0.84 ACE2 (0.55) FAAHCNR1CNR2ACE2LCK
SCHEMBL14040414 0.82 ACE2 (0.53) ACE2LCKPPARDZDHHC20ZDHHC2
SCHEMBL27950594 0.82 ACE2 (0.58) FAAHCNR1CNR2ACE2LCK
SCHEMBL11461313 0.82 ACE2 (0.53) FAAHACE2GPR84FFAR1MAPT
SCHEMBL1420886 0.82 ACE2 (0.52) FAAHCNR1CNR2ACE2LCK
SCHEMBL28716932 0.79 ACE2 (0.47) ACE2GPR84CA1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2013180698-A1 USE OF FAAH ANTAGONISTS FOR TREATING DRY EYE AND OCULAR PAIN ALCON RESEARCH, LTD. (US) 2013-12-05 WO disclosed
US-8207226-B1 Use of FAAH antagonists for treating dry eye and ocular pain ALCON RESEARCH, LTD. (US) 2012-06-26 US disclosed