SCHEMBL8745005

SCHEMBL8745005

CCCCCCOC(=O)[C@@H](O)[C@H](O)C(=O)OCCCCCC

nearest known ligand 0.70

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.59
EPHX1 P07099 1/20 0.55
TSHR P16473 3/20 0.53
HCAR2 Q8TDS4 1/20 0.50
RAD52 P43351 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
FAAH O00519 1/20 0.48
ALDH1A1 P00352 1/20 0.48
LMNA P02545 1/20 0.48
ACHE P22303 6/20 0.48

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
SCHEMBL8745023 1.00 NAAA (0.59) NAAAEPHX1TSHRHCAR2RAD52
SCHEMBL4270419 1.00 NAAA (0.59) NAAAEPHX1TSHRHCAR2RAD52
SCHEMBL27345328 1.00 NAAA (0.59) NAAAEPHX1TSHRHCAR2RAD52
SCHEMBL422570 1.00 NAAA (0.59) NAAAEPHX1TSHRHCAR2RAD52
SCHEMBL321605 1.00 NAAA (0.59) NAAAEPHX1TSHRHCAR2RAD52
SCHEMBL1052607 1.00 NAAA (0.59) NAAAEPHX1TSHRHCAR2RAD52
SCHEMBL1560117 1.00 NAAA (0.59) NAAAEPHX1TSHRHCAR2RAD52
SCHEMBL9723694 1.00 NAAA (0.59) NAAAEPHX1TSHRHCAR2RAD52
SCHEMBL8637982 1.00 NAAA (0.59) NAAAEPHX1TSHRHCAR2RAD52
SCHEMBL2289008 1.00 NAAA (0.59) NAAAEPHX1TSHRHCAR2RAD52

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0663897-B1 PROCESS FOR SEPARATING ENANTIOMERS FROM A RACEMIC MIXTURE AKZO NOBEL NV (NL) 1997-01-29 EP disclosed
EP-0663897-A1 PROCESS FOR SEPARATING ENANTIOMERS FROM A RACEMIC MIXTURE. AKZO NOBEL NV (NL) 1995-07-26 EP disclosed
WO-1994007814-A1 PROCESS FOR SEPARATING ENANTIOMERS FROM A RACEMIC MIXTURE AKZO NOBEL N.V. (NL) 1994-04-14 WO disclosed