SCHEMBL10869871

SCHEMBL10869871

CCCC1(N[C@@H](CO)C(=O)OC)CCCC1

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.34
CYP4A11 Q02928 1/20 0.34
MME P08473 3/20 0.33
CETP P11597 2/20 0.33
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
POLB P06746 1/20 0.31
TGFBR1 P36897 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
ZDHHC7 Q9NXF8 1/20 0.30
ATM Q13315 1/20 0.30

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
SCHEMBL16086443 0.71 ALDH1A1 (0.38) CYP4F2CYP4A11MMETGFBR1SMN1; SMN2
SCHEMBL16086203 0.70 ALDH1A1 (0.38) CYP4F2CYP4A11MMETGFBR1SMN1; SMN2
SCHEMBL5221342 0.70 CETP (0.36) CYP4F2CYP4A11MMECETPPOLB
SCHEMBL20573113 0.69 CA1 (0.39) CYP4F2CYP4A11CETPCA1CA2
SCHEMBL23375007 0.69 MME (0.40) MMECA1CA2POLBTGFBR1
SCHEMBL21309845 0.69 MME (0.40) MMECA1CA2POLBTGFBR1
SCHEMBL23374703 0.69 MME (0.40) MMECA1CA2POLBTGFBR1
SCHEMBL5216206 0.68 CETP (0.38) MMECETPPOLBSMN1; SMN2
SCHEMBL16086421 0.68 ALDH1A1 (0.41) MMEPOLBTGFBR1SMN1; SMN2ATM
SCHEMBL16086007 0.67 ALDH1A1 (0.40) MMEPOLBTGFBR1SMN1; SMN2ATM

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-0186173-A2 L-Aminodicarboxylic-(0-cycloalkyl)-L-aminocarboxylate alkyl esters, an edible composition containing same as sweeteners and a method for sweetening an edible composition GENERAL FOODS CORPORATION (US) 1986-07-02 EP disclosed