SCHEMBL1010540

SCHEMBL1010540

COC(=O)C(CCCCCCCCCCCO)C(=O)OC

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ZDHHC7 Q9NXF8 1/20 0.46
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
ACHE P22303 6/20 0.38
CYP4F2 P78329 3/20 0.38
CYP4A11 Q02928 3/20 0.38
TDP1 Q9NUW8 1/20 0.36
ABCB1 P08183 1/20 0.36
MME P08473 1/20 0.35
USP2 O75604 1/20 0.35
LMNA P02545 1/20 0.35
GPR84 Q9NQS5 1/20 0.34
FFAR1 O14842 1/20 0.34
FFAR4 Q5NUL3 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
ALOX5 P09917 1/20 0.34

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
SCHEMBL3016489 1.00 ZDHHC7 (0.46) ZDHHC7CA1CA2ACHECYP4F2
SCHEMBL5749745 0.91 CA1 (0.42) ZDHHC7CA1CA2ACHECYP4F2
SCHEMBL5694365 0.91 ZDHHC7 (0.52) ZDHHC7CA1CA2TDP1ABCB1
SCHEMBL8586333 0.90 ZDHHC7 (0.42) ZDHHC7CA1CA2ACHECYP4F2
SCHEMBL11648130 0.89 ZDHHC7 (0.48) ZDHHC7CA1CA2TDP1ABCB1
SCHEMBL27745855 0.85 TDP1 (0.45) ZDHHC7CA1CA2CYP4F2CYP4A11
SCHEMBL27745858 0.85 TDP1 (0.45) ZDHHC7CA1CA2CYP4F2CYP4A11
SCHEMBL31079658 0.84 ZDHHC7 (0.38) ZDHHC7CA1CA2ACHECYP4F2
SCHEMBL29825333 0.84 ZDHHC7 (0.38) ZDHHC7CA1CA2ACHECYP4F2
SCHEMBL11650719 0.84 CA1 (0.46) ZDHHC7CA1CA2TDP1ABCB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2268319-A2 PRECURSORS OF LIPID METABOLISM FOR THE DIAGNOSIS AND TREATMENT OF CANCER Universität Ulm (DE) 2011-01-05 EP disclosed
WO-2009109798-A2 PRECURSORS OF LIPID METABOLISM FOR THE DIAGNOSIS AND TREATMENT OF CANCER UNIVERSITÄT ULM (DE) 2009-09-11 WO disclosed