SCHEMBL11040688

SCHEMBL11040688

CC(C)(O)CC(C)(CO)CCCCO

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.33
CYP4A11 Q02928 1/20 0.33
ALDH1A1 P00352 1/20 0.33
SMN1; SMN2 Q16637 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
SCHEMBL10928501 0.83 CYP4F2 (0.39) CYP4F2CYP4A11ALDH1A1SMN1; SMN2
SCHEMBL9346162 0.80 CYP4F2 (0.42) CYP4F2CYP4A11ALDH1A1SMN1; SMN2
SCHEMBL12191374 0.80 SMN1; SMN2 (0.40) CYP4F2CYP4A11ALDH1A1SMN1; SMN2
SCHEMBL10557078 0.76 CYP4F2 (0.39) CYP4F2CYP4A11ALDH1A1SMN1; SMN2
SCHEMBL16074701 0.76 ALDH1A1 (0.36) CYP4F2CYP4A11ALDH1A1SMN1; SMN2
SCHEMBL377962 0.75
SCHEMBL16074791 0.74 CYP4F2 (0.38) CYP4F2CYP4A11ALDH1A1SMN1; SMN2
SCHEMBL16074827 0.74 CYP4F2 (0.38) CYP4F2CYP4A11ALDH1A1SMN1; SMN2
SCHEMBL16074798 0.74 CYP4F2 (0.38) CYP4F2CYP4A11ALDH1A1SMN1; SMN2
SCHEMBL16074812 0.74 CYP4F2 (0.38) CYP4F2CYP4A11ALDH1A1SMN1; SMN2

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-0043625-B1 MOTOR CAR REPAIR PAINT AKZO N.V. (NL) 1984-01-11 EP disclosed
US-4400479-A ACRYLATED ALKYD RESIN, A POLYACRYLATE AND A CELLULOSE ESTER IN THE BINDER AKZO NV (NL) 1983-08-23 US disclosed
EP-0043625-A1 Motor car repair paint AKZO N.V. (NL) 1982-01-13 EP disclosed