SCHEMBL5899092

SCHEMBL5899092

O=C(O)C(O)C(O)C(=O)OC[C@@]1(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK1 P06493 1/20 0.54
CCNB1 P14635 1/20 0.54
CA2 P00918 1/20 0.44
CA9 Q16790 1/20 0.44
LDHA P00338 1/20 0.39
EPHX2 P34913 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
SYNJ2 O15056 2/20 0.36
KDM4E B2RXH2 1/20 0.36
ABL1 P00519 1/20 0.36
ALPL P05186 1/20 0.36
POLB P06746 1/20 0.36
ALPI P09923 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
ALPG P10696 1/20 0.36
PABPC1 P11940 1/20 0.36
RECQL P46063 1/20 0.36
GALK1 P51570 1/20 0.36

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
SCHEMBL2471895 0.88 CDK1 (0.60) CDK1CCNB1CA2CA9LDHA
SCHEMBL9329571 0.87 CDK1 (0.52) CDK1CCNB1CA2CA9LDHA
SCHEMBL4268634 0.86 CDK1 (0.56) CDK1CCNB1CA2CA9LDHA
SCHEMBL6006583 0.84 CDK1 (0.45) CDK1CCNB1CA2CA9LDHA
SCHEMBL18167470 0.83 CDK1 (0.58) CDK1CCNB1CA2CA9LDHA
SCHEMBL891535 0.83 CDK1 (0.58) CDK1CCNB1CA2CA9LDHA
SCHEMBL28140183 0.83 CDK1 (0.58) CDK1CCNB1CA2CA9LDHA
SCHEMBL5503751 0.83 CDK1 (0.53) CDK1CCNB1CA2CA9LDHA
SCHEMBL888307 0.83 CDK1 (0.53) CDK1CCNB1CA2CA9LDHA
SCHEMBL21436340 0.83 CDK1 (0.67) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200305483-A1 SOURNESS ENHANCERS COMPRISING A CYCLOHEXANECARBOXYLIC ACID FIRMENICH SA (CH) 2020-10-01 US disclosed
EP-3654780-A1 SOURNESS ENHANCERS COMPRISING A CYCLOHEXANECARBOXYLIC ACID Firmenich SA (CH) 2020-05-27 EP disclosed
CN-111031808-A Sourness enhancer comprising cyclohexanecarboxylic acid 弗门尼舍有限公司 2020-04-17 CN disclosed
US-20060222694-A1 Stabilized topotecan liposomal composition and methods SMITHKLINE BEECHAM CORPORATION 2006-10-05 US disclosed
EP-1643972-A1 STABILIZED TOPOTECAN LIPOSOMAL COMPOSITION AND METHODS SMITHKLINE BEECHAM CORPORATION (US) 2006-04-12 EP disclosed
WO-2005002546-A1 STABILIZED TOPOTECAN LIPOSOMAL COMPOSITION AND METHODS SMITHKLINE BEECHAM CORPORATION (US) 2005-01-13 WO disclosed