SCHEMBL28795669

SCHEMBL28795669

OCCOCCOCCOCC(O)Br

nearest known ligand 0.55

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
TSHR P16473 2/20 0.50
MAPK1 P28482 1/20 0.50
THRB P10828 1/20 0.38
HTT P42858 1/20 0.38
MAPT P10636 1/20 0.38
ALDH1A1 P00352 1/20 0.36
HSD17B10 Q99714 1/20 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
SCHEMBL30365329 1.00 MEN1 (0.55) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL28213116 1.00 MEN1 (0.55) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL38656183 1.00 MEN1 (0.55) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL28328399 0.95
SCHEMBL5021533 0.79 MEN1 (0.61) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL6666230 0.79 MEN1 (0.61) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL3542017 0.79 MEN1 (0.61) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL15253483 0.79 MEN1 (0.61) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL18251584 0.79 MEN1 (0.61) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL16517850 0.76 MEN1 (0.65) MEN1KMT2ATSHRMAPK1THRB

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-216987571-U A reagent dropwise add device for bromo-four polyethylene glycol production 南京安淮创新药物研究院有限公司 2022-07-19 CN claimed
CN-117126068-A Compound and preparation method and application thereof 中国石油化工股份有限公司 2023-11-28 CN disclosed
CN-112143472-B Corrosion inhibitor and preparation method and application thereof 中国石油化工股份有限公司 2023-10-10 CN disclosed
CN-115873018-A Benzopyrimidine and phentriazine hematopoietic progenitor cell kinase 1 degradation agent and application thereof 中国药科大学 2023-03-31 CN disclosed
CN-115710271-A Polymerizable vitamin B2 analogue and preparation method thereof 上海交通大学 2023-02-24 CN disclosed
CN-217540390-U Bromo-tetrapolyethylene glycol production shunting equipment 南京安淮创新药物研究院有限公司 2022-10-04 CN disclosed
CN-216987571-U A reagent dropwise add device for bromo-four polyethylene glycol production 南京安淮创新药物研究院有限公司 2022-07-19 CN disclosed
CN-216987571-U A reagent dropwise add device for bromo-four polyethylene glycol production 南京安淮创新药物研究院有限公司 2022-07-19 CN disclosed