SCHEMBL27892157

SCHEMBL27892157

OC[C@H]1O[C@@](CO)(O[C@H]2O[C@H](COO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]1O.[NaH]

nearest known ligand 0.75

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CDK1 P06493 1/20 0.75
CCNB1 P14635 1/20 0.75
CA2 P00918 1/20 0.49
CA9 Q16790 1/20 0.49
LDHA P00338 1/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
EPHX2 P34913 3/20 0.40
ADORA1 P30542 1/20 0.38
GAA P10253 1/20 0.35
TYR P14679 1/20 0.35
ACHE P22303 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.33
POLB P06746 1/20 0.33

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
SCHEMBL127859 0.99 CDK1 (0.77) CDK1CCNB1CA2CA9LDHA
Water SCHEMBL21694095 0.97 CDK1 (0.75) CDK1CCNB1CA2CA9LDHA
SCHEMBL2259425 0.97 CDK1 (0.75) CDK1CCNB1CA2CA9LDHA
SCHEMBL10880542 0.97 CDK1 (0.75) CDK1CCNB1CA2CA9LDHA
SCHEMBL98497 0.97 CDK1 (0.75) CDK1CCNB1CA2CA9LDHA
Water SCHEMBL21694093 0.96 CDK1 (0.73) CDK1CCNB1CA2CA9LDHA
Sucrose SCHEMBL28188927 0.90 CDK1 (0.80) CDK1CCNB1CA2CA9LDHA
Sucrose SCHEMBL2128496 0.90 CDK1 (0.80) CDK1CCNB1CA2CA9LDHA
SCHEMBL245645 0.89 CDK1 (0.79) CDK1CCNB1CA2CA9LDHA
Sucrose SCHEMBL24202550 0.89 CDK1 (0.82) CDK1CCNB1CA2CA9LDHA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102731583-B Preparation method of sucrose benzoate ZHEJIANG DEYER CHEMICALS CO LTD 2014-08-13 CN claimed
CN-102731583-A Preparation method of sucrose benzoate ZHEJIANG DEYER CHEMICALS CO LTD 2012-10-17 CN claimed
CN-102936269-B A kind of preparation method of full substituting saccharose benzoic ether TAICANG QIANJING CHEMICAL CO., LTD. (CN) 2015-08-19 CN disclosed
CN-102731583-B Preparation method of sucrose benzoate ZHEJIANG DEYER CHEMICALS CO LTD 2014-08-13 CN disclosed
CN-102731583-B Preparation method of sucrose benzoate ZHEJIANG DEYER CHEMICALS CO LTD 2014-08-13 CN disclosed
CN-102936269-A Preparation method of all-substituted sucrose benzoate TAICANG QIANJING CHEMICAL CO LTD 2013-02-20 CN disclosed
CN-102731583-A Preparation method of sucrose benzoate ZHEJIANG DEYER CHEMICALS CO LTD 2012-10-17 CN disclosed
CN-102731583-A Preparation method of sucrose benzoate ZHEJIANG DEYER CHEMICALS CO LTD 2012-10-17 CN disclosed