SCHEMBL905446

SCHEMBL905446

CCCC[C@@H](C)OC(=O)CC(=O)O[C@H](C)CCCC

nearest known ligand 0.64

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FAAH O00519 5/20 0.64
CNR1 P21554 1/20 0.64
CNR2 P34972 1/20 0.64
EPHX2 P34913 1/20 0.47
LMNA P02545 2/20 0.44
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
CTSK P43235 2/20 0.41
NAAA Q02083 1/20 0.41
SLC15A1 P46059 1/20 0.40
KDM4E B2RXH2 1/20 0.39
KMT2A Q03164 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
CYP3A4 P08684 1/20 0.39
TSHR P16473 1/20 0.39
ATM Q13315 1/20 0.39
TDP1 Q9NUW8 1/20 0.39

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
SCHEMBL905488 1.00 FAAH (0.64) FAAHCNR1CNR2EPHX2LMNA
SCHEMBL5862453 0.94 FAAH (0.72) FAAHCNR1CNR2EPHX2LMNA
SCHEMBL7945793 0.92 FAAH (0.75) FAAHCNR1CNR2LMNAALDH1A1
SCHEMBL1042652 0.92 FAAH (0.75) FAAHCNR1CNR2LMNAALDH1A1
SCHEMBL8506453 0.92 FAAH (0.75) FAAHCNR1CNR2LMNAALDH1A1
SCHEMBL28507254 0.92 FAAH (0.75) FAAHCNR1CNR2LMNAALDH1A1
SCHEMBL5467177 0.90 FAAH (0.58) FAAHCNR1CNR2EPHX2LMNA
SCHEMBL4445232 0.90 FAAH (0.58) FAAHCNR1CNR2EPHX2LMNA
SCHEMBL2728978 0.90 FAAH (0.58) FAAHCNR1CNR2EPHX2LMNA
SCHEMBL28729643 0.90 FAAH (0.73) FAAHCNR1CNR2LMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080233621-A1 Method For Producing Alcohol and Carboxylic Acid Having Optical Activity API CORPORATION (JP) 2008-09-25 US claimed
EP-1712630-A1 PROCESS FOR PRODUCING OPTICALLY ACTIVE ALCOHOL AND CARBOXYLIC ACID API Corporation (JP) 2006-10-18 EP claimed
EP-2278014-A2 Method for producing alcohol and carboxylic acid having optical activity API Corporation (JP) 2011-01-26 EP disclosed
EP-2270178-A2 Method for producing alcohol and carboxylic acid having optical activity API Corporation (JP) 2011-01-05 EP disclosed
US-20080233621-A1 Method For Producing Alcohol and Carboxylic Acid Having Optical Activity API CORPORATION (JP) 2008-09-25 US disclosed
CN-1950508-A Process for producing optically active alcohol and carboxylic acid API CORP (JP) 2007-04-18 CN disclosed
EP-1712630-A1 PROCESS FOR PRODUCING OPTICALLY ACTIVE ALCOHOL AND CARBOXYLIC ACID API Corporation (JP) 2006-10-18 EP disclosed