SCHEMBL6232174

SCHEMBL6232174

COC(=O)C1CCN1[C@H](C)c1ccc(Cl)cc1

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.58
MDM2 Q00987 1/20 0.48
SLC6A4 P31645 2/20 0.43
SLC6A3 Q01959 2/20 0.43
HSD11B1 P28845 1/20 0.43
SLC6A2 P23975 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
GAA P10253 1/20 0.42
HPGD P15428 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL7067185 1.00 TSHR (0.58) TSHRMDM2SLC6A4SLC6A3HSD11B1
SCHEMBL6231109 1.00 TSHR (0.58) TSHRMDM2SLC6A4SLC6A3HSD11B1
SCHEMBL7066127 0.88 TSHR (0.46) TSHRMDM2SLC6A4SLC6A3HSD11B1
SCHEMBL6229831 0.87 TSHR (0.45) TSHRSLC6A4SLC6A3SLC6A2
SCHEMBL6232109 0.87 TSHR (0.45) TSHRSLC6A4SLC6A3SLC6A2
SCHEMBL6231643 0.87 TSHR (0.45) TSHRMDM2SLC6A3
SCHEMBL7062874 0.87 TSHR (0.45) TSHRSLC6A4SLC6A3SLC6A2
SCHEMBL6233893 0.87 TSHR (0.45) TSHRMDM2SLC6A3
SCHEMBL7068098 0.86 PKM (0.44) TSHRSLC6A4SLC6A3HSD11B1SLC6A2
SCHEMBL6233365 0.86 PKM (0.44) TSHRSLC6A4SLC6A3HSD11B1SLC6A2

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-1201653-B1 Method for racemization of optically active azetidine-2-Carboxylate SUMITOMO CHEMICAL CO (JP) 2005-04-20 EP disclosed
EP-0957089-B1 Method for racemization of optically active azetidine-2-carboxylate SUMITOMO CHEMICAL CO (JP) 2003-09-17 EP disclosed
EP-1201653-A1 Method for racemization of optically active azetidine-2-Carboxylate SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-05-02 EP disclosed
EP-0957089-A1 Method for racemization of optically active azetidine-2-carboxylate SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-11-17 EP disclosed