SCHEMBL8070650

SCHEMBL8070650

CCOC(=O)C(O)(CO)CCCCCCOCc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 5/20 0.45
TDP1 Q9NUW8 2/20 0.41
ALDH1A1 P00352 3/20 0.40
GAA P10253 2/20 0.40
RECQL P46063 1/20 0.40
MMP8 P22894 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
EPHX2 P34913 1/20 0.40
MBOAT4 Q96T53 1/20 0.39
PIN1 Q13526 1/20 0.39
CYP3A4 P08684 1/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
NAAA Q02083 1/20 0.38

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
SCHEMBL8074868 0.87 TBXAS1 (0.47) L3MBTL1TDP1ALDH1A1KMT2A
SCHEMBL8609385 0.86 L3MBTL1 (0.47) L3MBTL1TDP1ALDH1A1GAARECQL
SCHEMBL5301360 0.86 L3MBTL1 (0.44) L3MBTL1TDP1ALDH1A1GAARECQL
SCHEMBL8712660 0.85 L3MBTL1 (0.46) L3MBTL1TDP1GAAMEN1KMT2A
SCHEMBL879888 0.85 MMP8 (0.51) L3MBTL1TDP1ALDH1A1RECQLMMP8
SCHEMBL22071031 0.85 CYP4F2 (0.52) L3MBTL1TDP1ALDH1A1RECQLMMP8
SCHEMBL30533338 0.85 CYP4F2 (0.52) L3MBTL1TDP1ALDH1A1RECQLMMP8
SCHEMBL850989 0.85 MMP8 (0.51) L3MBTL1TDP1ALDH1A1RECQLMMP8
SCHEMBL30533340 0.85 CYP4F2 (0.52) L3MBTL1TDP1ALDH1A1RECQLMMP8
SCHEMBL14782773 0.84 L3MBTL1 (0.46) L3MBTL1TDP1ALDH1A1GAARECQL

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-6030993-A INHIBITORS OF CARNITINE PALMITOYL TRANSFERASE; ANTIDIABETIC,-LIPEMIC AND HYPOGLYCEMIC AGENTS; SIDE EFFECT REDUCTION SANG SUP JEW (KR) 2000-02-29 US disclosed