SCHEMBL20503263

SCHEMBL20503263

CCCCCCCCCCNOC(C)=O

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.52
EPHX1 P07099 10/20 0.50
CASP2 P42575 1/20 0.45
CNR2 P34972 1/20 0.44
ZDHHC20 Q5W0Z9 1/20 0.42
ZDHHC2 Q9UIJ5 1/20 0.42
NAAA Q02083 1/20 0.42
ALDH1A1 P00352 1/20 0.41
ADH1B P00325 1/20 0.41
ADH1C P00326 1/20 0.41
ADH1A P07327 1/20 0.41
ADH4 P08319 1/20 0.41
ADH7 P40394 1/20 0.41
CES2 O00748 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
SCHEMBL20959807 1.00 FAAH (0.52) FAAHEPHX1CASP2CNR2ZDHHC20
SCHEMBL18843429 1.00 FAAH (0.52) FAAHEPHX1CASP2CNR2ZDHHC20
SCHEMBL29441797 1.00 FAAH (0.52) FAAHEPHX1CASP2CNR2ZDHHC20
SCHEMBL11152873 1.00 FAAH (0.52) FAAHEPHX1CASP2CNR2ZDHHC20
SCHEMBL11318606 1.00 FAAH (0.52) FAAHEPHX1CASP2CNR2ZDHHC20
SCHEMBL19970455 1.00 FAAH (0.52) FAAHEPHX1CASP2CNR2ZDHHC20
SCHEMBL23528236 1.00 FAAH (0.52) FAAHEPHX1CASP2CNR2ZDHHC20
SCHEMBL11329413 1.00 FAAH (0.52) FAAHEPHX1CASP2CNR2ZDHHC20
SCHEMBL28396415 0.98 FAAH (0.50) FAAHEPHX1CASP2CNR2ZDHHC20
SCHEMBL29129919 0.98 FAAH (0.50) FAAHEPHX1CASP2CNR2ZDHHC20

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
EP-3377473-A1 MACROCYCLIC BROAD SPECTRUM ANTIBIOTICS RQX Pharmaceuticals, Inc. (US) 2018-09-26 EP disclosed