SCHEMBL29065825

SCHEMBL29065825

COC(=O)[C@H]1O[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1O.[NaH]

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LGALS3 P17931 1/20 0.43
CA1 P00915 5/20 0.40
CA2 P00918 5/20 0.40
CA9 Q16790 5/20 0.40
AHCY P23526 1/20 0.36
PYGB P11216 1/20 0.36
CYP2C19 P33261 1/20 0.34
CA12 O43570 3/20 0.33
PPM1B O75688 1/20 0.32
PTPN1 P18031 1/20 0.32
PPP1CC P36873 1/20 0.32
CDK1 P06493 1/20 0.32
CCNB1 P14635 1/20 0.32
LGALS8 O00214 2/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
ITGA4 P13612 1/20 0.32
CA14 Q9ULX7 2/20 0.31

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
SCHEMBL26243844 0.98 LGALS3 (0.44) LGALS3CA1CA2CA9AHCY
SCHEMBL30660898 0.98 LGALS3 (0.44) LGALS3CA1CA2CA9AHCY
SCHEMBL30353978 0.98 LGALS3 (0.44) LGALS3CA1CA2CA9AHCY
SCHEMBL1811839 0.98 LGALS3 (0.44) LGALS3CA1CA2CA9AHCY
SCHEMBL12085049 0.98 LGALS3 (0.44) LGALS3CA1CA2CA9AHCY
SCHEMBL185267 0.98 LGALS3 (0.44) LGALS3CA1CA2CA9AHCY
SCHEMBL4096725 0.98 LGALS3 (0.44) LGALS3CA1CA2CA9AHCY
SCHEMBL12082047 0.98 LGALS3 (0.44) LGALS3CA1CA2CA9AHCY
SCHEMBL7154268 0.98 LGALS3 (0.44) LGALS3CA1CA2CA9AHCY
SCHEMBL4107459 0.98 LGALS3 (0.44) LGALS3CA1CA2CA9AHCY

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
CN-115430469-B Sliding micro-fluidic chip for rapidly detecting pathogenic bacteria 中国科学院上海微系统与信息技术研究所 2023-08-04 CN claimed
CN-115430469-A Sliding micro-fluidic chip for rapid detection of pathogenic bacteria 中国科学院上海微系统与信息技术研究所 2022-12-06 CN claimed
CN-115430469-B Sliding micro-fluidic chip for rapidly detecting pathogenic bacteria 中国科学院上海微系统与信息技术研究所 2023-08-04 CN disclosed
CN-115430469-A Sliding micro-fluidic chip for rapid detection of pathogenic bacteria 中国科学院上海微系统与信息技术研究所 2022-12-06 CN disclosed