SCHEMBL9420657

SCHEMBL9420657

CCCCCCC(S)C(=O)OC(C)OCC

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FAAH O00519 5/20 0.42
CA1 P00915 2/20 0.41
ZDHHC7 Q9NXF8 1/20 0.40
LMNA P02545 2/20 0.39
ABCB1 P08183 1/20 0.38
CNR1 P21554 1/20 0.38
CNR2 P34972 1/20 0.38
ACE2 Q9BYF1 1/20 0.38
GPR84 Q9NQS5 3/20 0.37
FFAR1 O14842 1/20 0.37
MAPT P10636 1/20 0.36
TP53 P04637 1/20 0.36

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
SCHEMBL9420641 0.84 SMPD1 (0.41) FAAHZDHHC7LMNAABCB1GPR84
SCHEMBL11358572 0.83 FAAH (0.46) FAAHCA1ZDHHC7LMNAABCB1
SCHEMBL9420758 0.82 SMPD1 (0.39) FAAHCA1ZDHHC7ABCB1CNR1
SCHEMBL2134793 0.81 LMNA (0.48) FAAHCA1ZDHHC7LMNAABCB1
SCHEMBL8648692 0.81 ZDHHC7 (0.48) FAAHZDHHC7ACE2GPR84FFAR1
SCHEMBL10889697 0.81 ZDHHC7 (0.48) FAAHZDHHC7ACE2GPR84FFAR1
SCHEMBL9554974 0.81 ZDHHC7 (0.48) FAAHZDHHC7ACE2GPR84FFAR1
SCHEMBL6306411 0.81 ZDHHC7 (0.48) FAAHZDHHC7ACE2GPR84FFAR1
SCHEMBL11127914 0.81 ZDHHC7 (0.48) FAAHZDHHC7ACE2GPR84FFAR1
SCHEMBL27459133 0.81 ZDHHC7 (0.48) FAAHZDHHC7ACE2GPR84FFAR1

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-5354800-A Emulsion polymerization of addition monomers with hydrophilic and hydrophobic chain transfer agent TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1994-10-11 US disclosed