SCHEMBL18856239

SCHEMBL18856239

CCCCCCCCC(C)OC(=O)CC(C)C

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FAAH O00519 5/20 0.61
CNR1 P21554 1/20 0.61
CNR2 P34972 1/20 0.61
ALDH1A1 P00352 1/20 0.48
LMNA P02545 2/20 0.47
MAPT P10636 1/20 0.47
NAAA Q02083 1/20 0.43
GPR84 Q9NQS5 4/20 0.43
MMP1 P03956 1/20 0.43
MMP2 P08253 1/20 0.43
MMP3 P08254 1/20 0.43
MMP9 P14780 1/20 0.43
MMP13 P45452 1/20 0.43
ACE2 Q9BYF1 1/20 0.42
KDM4E B2RXH2 1/20 0.42
KMT2A Q03164 1/20 0.42
L3MBTL1 Q9Y468 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
SCHEMBL28158241 0.98 FAAH (0.58) FAAHCNR1CNR2ALDH1A1LMNA
SCHEMBL31426915 0.92 FAAH (0.51) FAAHCNR1CNR2ALDH1A1LMNA
SCHEMBL23934069 0.85 MAPK1 (0.49) FAAHCNR1CNR2ALDH1A1LMNA
SCHEMBL25802990 0.85 MAPK1 (0.49) FAAHCNR1CNR2ALDH1A1LMNA
SCHEMBL13126847 0.85 FAAH (0.65) FAAHCNR1CNR2ALDH1A1LMNA
SCHEMBL6906595 0.85 FAAH (0.65) FAAHCNR1CNR2ALDH1A1LMNA
SCHEMBL9447664 0.85 FAAH (0.65) FAAHCNR1CNR2ALDH1A1LMNA
SCHEMBL8994200 0.85 FAAH (0.65) FAAHCNR1CNR2ALDH1A1LMNA
SCHEMBL6339017 0.85 FAAH (0.65) FAAHCNR1CNR2ALDH1A1LMNA
SCHEMBL8506453 0.85 FAAH (0.75) FAAHCNR1CNR2ALDH1A1LMNA

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
US-9650341-B2 Process for synthesizing oxidized lactam compounds ALKERMES PHARMA IRELAND LIMITED (IE) 2017-05-16 US disclosed