SCHEMBL27705258

SCHEMBL27705258

CCCCCCCCCCCCC(C)C(=O)ON

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.53
ACE2 Q9BYF1 1/20 0.48
ZDHHC7 Q9NXF8 1/20 0.47
FAAH O00519 1/20 0.45
FFAR1 O14842 2/20 0.44
FFAR4 Q5NUL3 1/20 0.44
GPR84 Q9NQS5 3/20 0.44
FDPS P14324 3/20 0.44
SPHK1 Q9NYA1 1/20 0.44
MAPT P10636 2/20 0.42
TP53 P04637 1/20 0.42
LCK P06239 1/20 0.42
PPARD Q03181 1/20 0.42
ZDHHC20 Q5W0Z9 1/20 0.42
ZDHHC2 Q9UIJ5 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
SCHEMBL29030101 1.00 CA1 (0.53) CA1ACE2ZDHHC7FAAHFFAR1
SCHEMBL27941132 1.00 CA1 (0.53) CA1ACE2ZDHHC7FAAHFFAR1
SCHEMBL3683616 1.00 CA1 (0.53) CA1ACE2ZDHHC7FAAHFFAR1
SCHEMBL27934015 1.00 CA1 (0.53) CA1ACE2ZDHHC7FAAHFFAR1
SCHEMBL4437589 1.00 CA1 (0.53) CA1ACE2ZDHHC7FAAHFFAR1
Hydrochloric Acid SCHEMBL28791309 0.98 CA1 (0.52) CA1ACE2ZDHHC7FAAHFFAR1
Hydrochloric Acid SCHEMBL28252093 0.98 CA1 (0.52) CA1ACE2ZDHHC7FAAHFFAR1
Hydrochloric Acid SCHEMBL28874235 0.98 CA1 (0.52) CA1ACE2ZDHHC7FAAHFFAR1
Hydrochloric Acid SCHEMBL27438803 0.98 CA1 (0.52) CA1ACE2ZDHHC7FAAHFFAR1
SCHEMBL8568010 0.92 CA1 (0.47) CA1ACE2ZDHHC7FDPS

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
CN-103857793-A Biotechnological process for the synthesis of omega-functionalized carboxylic acids and esters from simple carbon sources EVONIK DEGUSSA GMBH 2014-06-11 CN disclosed
CN-101068856-A Method for producing an aqueous polyamide dispersion BASF AG (DE) 2007-11-07 CN disclosed