SCHEMBL27712299

SCHEMBL27712299

CC(=O)OC(C(C)O)C(O)(C(C)=O)C(=O)C(C)=O

nearest known ligand 0.37

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.37

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
SCHEMBL29666105 1.00 TSHR (0.37) TSHR
SCHEMBL6468067 0.77 TDP1 (0.33)
SCHEMBL6463162 0.77 TDP1 (0.33)
SCHEMBL9230880 0.77 TDP1 (0.30)
SCHEMBL5678671 0.71
SCHEMBL30723226 0.67 TSHR (0.33) TSHR
SCHEMBL30449566 0.67 TSHR (0.33) TSHR
SCHEMBL28477316 0.67 TSHR (0.33) TSHR
SCHEMBL12207104 0.66 TSHR (0.50) TSHR
SCHEMBL12233459 0.66 TSHR (0.50) TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109369736-B Preparation method of high-purity capecitabine key intermediate 广安凯特制药有限公司 2022-06-17 CN claimed
CN-104650160-A Novel synthesis method of capecitabine key intermediate 1,2,3-O-triacetyl-5-deoxy-D-ribose UNIV JINAN 2015-05-27 CN claimed
CN-109369736-B Preparation method of high-purity capecitabine key intermediate 广安凯特制药有限公司 2022-06-17 CN disclosed
CN-109369736-B Preparation method of high-purity capecitabine key intermediate 广安凯特制药有限公司 2022-06-17 CN disclosed
CN-104650160-A Novel synthesis method of capecitabine key intermediate 1,2,3-O-triacetyl-5-deoxy-D-ribose UNIV JINAN 2015-05-27 CN disclosed
CN-104650160-A Novel synthesis method of capecitabine key intermediate 1,2,3-O-triacetyl-5-deoxy-D-ribose UNIV JINAN 2015-05-27 CN disclosed
CN-104650160-A Novel synthesis method of capecitabine key intermediate 1,2,3-O-triacetyl-5-deoxy-D-ribose UNIV JINAN 2015-05-27 CN disclosed
CN-104130297-A Method for synthesizing capecitabine key intermediate by using high-efficiency dehydrating agent UNIV JINAN 2014-11-05 CN disclosed
CN-101182342-A Method for synthesizing 1,2,3-O-tri-acetyl-5-deoxidation-D-ribose UNIV HEFEI (CN) 2008-05-21 CN disclosed