SCHEMBL9015632

SCHEMBL9015632

CCCCCCCC(S)C(=O)OC(C)CC(C)(C)OOC(C)(C)C

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FAAH O00519 5/20 0.42
CNR1 P21554 1/20 0.35
CNR2 P34972 1/20 0.35
ZDHHC7 Q9NXF8 1/20 0.34
ABCB1 P08183 1/20 0.33
LMNA P02545 3/20 0.33
ALDH1A1 P00352 1/20 0.33
USP2 O75604 1/20 0.33
CA2 P00918 1/20 0.33
SMPD1 P17405 3/20 0.32
ACE2 Q9BYF1 1/20 0.32
GPR84 Q9NQS5 1/20 0.31

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
SCHEMBL9015721 0.82 CA2 (0.39) FAAHCNR1CNR2CA2
SCHEMBL9015709 0.80 ZDHHC7 (0.36) FAAHZDHHC7LMNAUSP2CA2
SCHEMBL11430363 0.75 ALDH1A1 (0.37) FAAHALDH1A1
SCHEMBL11358572 0.75 FAAH (0.46) FAAHCNR1CNR2ZDHHC7ABCB1
SCHEMBL2134793 0.73 LMNA (0.48) FAAHCNR1CNR2ZDHHC7ABCB1
SCHEMBL9015657 0.73 NAAA (0.36) ZDHHC7ABCB1LMNAUSP2CA2
SCHEMBL9015636 0.72 LMNA (0.40) FAAHCNR1CNR2LMNAALDH1A1
SCHEMBL2137806 0.72 ZDHHC7 (0.41) FAAHZDHHC7CA2SMPD1GPR84
SCHEMBL362758 0.71 TSHR (0.32)
SCHEMBL15638507 0.70 CA2 (0.47) FAAHUSP2CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0344733-A2 Novel antioxidant-peroxides and their use ELF ATOCHEM NORTH AMERICA, INC. (US) 1989-12-06 EP claimed
US-5516856-A IMPROVED PROCESS FOR THE MODIFICATION OF THE MOLECULAR CHAIN OF A POLYMER ELF ATOCHEM NORTH AMERICA, INC. (US) 1996-05-14 US disclosed
US-5051531-A As polymerization catalysts and for crosslinking ATOCHEM NORTH AMERICA, INC. (US) 1991-09-24 US disclosed
EP-0344733-A2 Novel antioxidant-peroxides and their use ELF ATOCHEM NORTH AMERICA, INC. (US) 1989-12-06 EP disclosed