SCHEMBL7873167

SCHEMBL7873167

COC(=O)c1cccc(C(=O)OC2CC(C)(C)N(O)C(C)(C)C2)c1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.54
HTT P42858 1/20 0.54
TSHR P16473 2/20 0.52
KMT2A Q03164 3/20 0.46
ALDH1A1 P00352 3/20 0.44
EPHX2 P34913 2/20 0.43
MAPT P10636 1/20 0.43
HPGD P15428 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.42
LOXL2 Q9Y4K0 1/20 0.41
KDM4E B2RXH2 1/20 0.41
CYP4F2 P78329 1/20 0.40
CYP4A11 Q02928 1/20 0.40

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
SCHEMBL565530 0.94 GAA (0.59) GAAHTTTSHRKMT2AALDH1A1
SCHEMBL27487510 0.89 TSHR (0.55) GAAHTTTSHRKMT2AALDH1A1
SCHEMBL20711670 0.89 GAA (0.56) GAAHTTTSHRKMT2AALDH1A1
SCHEMBL18072216 0.85 GAA (0.57) GAAHTTTSHRKMT2AALDH1A1
SCHEMBL243559 0.84 TSHR (0.70) GAAHTTTSHRKMT2AALDH1A1
SCHEMBL7477447 0.83 TSHR (0.61) GAAHTTTSHRKMT2AALDH1A1
SCHEMBL11336780 0.83 TSHR (0.57) GAAHTTTSHRKMT2AALDH1A1
SCHEMBL1535633 0.82 GAA (0.61) GAAHTTTSHRKMT2AALDH1A1
SCHEMBL24430225 0.80 TSHR (0.49) GAAHTTTSHRKMT2AALDH1A1
SCHEMBL14372130 0.80 GAA (0.52) GAAHTTTSHRKMT2AALDH1A1

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 4 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
US-5574163-A TRANSESTERIFICATION CIBA-GEIGY CORPORATION (US) 1996-11-12 US 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