SCHEMBL6064079

SCHEMBL6064079

CC(CC(C)(C)C(=O)O)C(=O)OCCCCCCO

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 2/20 0.39
CYP4A11 Q02928 2/20 0.39
ACACB O00763 1/20 0.38
ACACA Q13085 1/20 0.38
ACHE P22303 6/20 0.37
TDP1 Q9NUW8 1/20 0.33
ACLY P53396 1/20 0.32
GPR84 Q9NQS5 1/20 0.31
FFAR1 O14842 1/20 0.31
FFAR4 Q5NUL3 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
SCHEMBL16438140 0.92 ACACB (0.39) ACACBACACATDP1ACLY
SCHEMBL13345987 0.86 ALDH1A1 (0.44) ACACBACACATDP1GPR84FFAR1
SCHEMBL2530032 0.75 ACHE (0.47) CYP4F2CYP4A11ACHE
SCHEMBL2529447 0.75 ACHE (0.47) CYP4F2CYP4A11ACHE
SCHEMBL2617898 0.75 MMP8 (0.40) CYP4F2CYP4A11ACACBACACA
SCHEMBL12085235 0.74 ACHE (0.39) CYP4F2CYP4A11ACHEGPR84FFAR1
SCHEMBL8230929 0.73 ACE2 (0.43) ACHE
SCHEMBL14417072 0.73 CYP4F2 (0.49) CYP4F2CYP4A11ACHETDP1
SCHEMBL14417104 0.73 CYP4F2 (0.49) CYP4F2CYP4A11ACHETDP1
SCHEMBL17278939 0.73 ACACB (0.37) ACACBACACAACLY

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
EP-1707600-A1 Aqueous radiation-curable binder composition Cytec Surface Specialties Austria GmbH (AT) 2006-10-04 EP disclosed