SCHEMBL7877415

SCHEMBL7877415

CCOC(=O)CCCC(=O)OC1CC(C)(C)N(O)C(C)(C)C1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMYD3 Q9H7B4 1/20 0.42
CYP1A2 P05177 1/20 0.41
RAB9A P51151 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
GAA P10253 1/20 0.39
HTT P42858 1/20 0.39
USP2 O75604 1/20 0.39
ALDH1A1 P00352 1/20 0.39
ALOX15 P16050 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
NAAA Q02083 2/20 0.39
EPHX2 P34913 10/20 0.39
SMN1; SMN2 Q16637 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
SCHEMBL7880696 0.96 NAAA (0.44) SMYD3CYP1A2RAB9AL3MBTL1GAA
SCHEMBL7873193 0.94 GAA (0.41) SMYD3CYP1A2RAB9AL3MBTL1GAA
SCHEMBL6299625 0.91 GAA (0.44) L3MBTL1GAAHTTALDH1A1NAAA
SCHEMBL316372 0.88 SMN1; SMN2 (0.47) L3MBTL1GAAHTTALDH1A1NAAA
SCHEMBL9092614 0.87 EPHX2 (0.38) SMYD3USP2ALDH1A1ALOX15TDP1
SCHEMBL5198311 0.86 NAAA (0.49) GAAHTTNAAASMN1; SMN2
SCHEMBL6905751 0.86 NAAA (0.47) L3MBTL1GAAHTTNAAAEPHX2
SCHEMBL30595294 0.86 NAAA (0.47) L3MBTL1GAAHTTNAAAEPHX2
SCHEMBL755468 0.86 NAAA (0.47) L3MBTL1GAAHTTNAAAEPHX2
SCHEMBL12382052 0.86 NAAA (0.47) L3MBTL1GAAHTTNAAAEPHX2

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-0703220-B1 Process for the preparation of N-oxyl hindered amine esters using tetraalkyl orthotitanate tranesterification catalysts CIBA SC HOLDING AG (CH) 2001-01-03 EP claimed
EP-0703220-A1 Process for the preparation of N-oxyl hindered amine esters using tetraalkyl orthotitanate tranesterification catalysts CIBA-GEIGY AG (CH) 1996-03-27 EP claimed
EP-0703220-B1 Process for the preparation of N-oxyl hindered amine esters using tetraalkyl orthotitanate tranesterification catalysts CIBA SC HOLDING AG (CH) 2001-01-03 EP disclosed