SCHEMBL11095613

SCHEMBL11095613

CCCCCCCCCCC(C)OC(=O)NC

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FAAH O00519 5/20 0.57
CNR1 P21554 1/20 0.57
CNR2 P34972 1/20 0.57
NAAA Q02083 1/20 0.54
EPHX1 P07099 1/20 0.52
KDM4E B2RXH2 1/20 0.51
KMT2A Q03164 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
ALDH1A1 P00352 1/20 0.48
ZDHHC7 Q9NXF8 1/20 0.44
LMNA P02545 2/20 0.43
ABCB1 P08183 1/20 0.42
ACE2 Q9BYF1 1/20 0.42
GPR84 Q9NQS5 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
SCHEMBL11272584 1.00 FAAH (0.57) FAAHCNR1CNR2NAAAEPHX1
SCHEMBL10639411 1.00 FAAH (0.57) FAAHCNR1CNR2NAAAEPHX1
SCHEMBL10633033 1.00 FAAH (0.57) FAAHCNR1CNR2NAAAEPHX1
SCHEMBL5249488 0.84 CHRNB2 (0.40) FAAHCNR1CNR2NAAAEPHX1
SCHEMBL2538589 0.84 FAAH (0.41) FAAHCNR1CNR2NAAAEPHX1
SCHEMBL11019265 0.84 FAAH (0.55) FAAHCNR1CNR2NAAAEPHX1
SCHEMBL22539940 0.83 EPHX1 (0.53) FAAHCNR1CNR2EPHX1ZDHHC7
SCHEMBL10636400 0.82 FAAH (0.58) FAAHCNR1CNR2NAAAEPHX1
SCHEMBL2537578 0.81 FAAH (0.39) FAAHCNR1CNR2NAAAEPHX1
SCHEMBL4923883 0.81 FAAH (0.60) FAAHCNR1CNR2NAAAKDM4E

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
EP-0048368-B1 PROCESS FOR THE PREPARATION OF N- AND O-SUBSTITUTED MONO- OR BIS-URETHANES BAYER AG (DE) 1984-06-13 EP disclosed
EP-0048368-A2 Process for the preparation of N- and O-substituted mono- or bis-urethanes BAYER AG (DE) 1982-03-31 EP disclosed