SCHEMBL23568261

SCHEMBL23568261

CC(C)(C)OC(=O)NCC(=O)NCCCN=[N+]=[N-]

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.45
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
MEN1 O00255 1/20 0.43
GAA P10253 1/20 0.43
KMT2A Q03164 1/20 0.43
CA1 P00915 8/20 0.39
CA2 P00918 8/20 0.39
CA12 O43570 5/20 0.39
CA9 Q16790 5/20 0.39
TLR2 O60603 1/20 0.35
TLR1 Q15399 1/20 0.35
HDAC8 Q9BY41 1/20 0.34
HTT P42858 1/20 0.33
MIF P14174 1/20 0.33
CCNC P24863 1/20 0.33
CDK8 P49336 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
SCHEMBL13752093 0.90 TDP1 (0.56) TDP1MAOAMAOBMEN1GAA
SCHEMBL23568928 0.87 TDP1 (0.48) TDP1MAOAMAOBMEN1GAA
SCHEMBL15798200 0.85 TDP1 (0.58) TDP1MAOAMAOBMEN1GAA
SCHEMBL22688016 0.84 TDP1 (0.38) TDP1MAOAMAOBMEN1GAA
SCHEMBL29991492 0.84 TDP1 (0.61) TDP1MAOAMAOBMEN1GAA
SCHEMBL21756460 0.84 TDP1 (0.61) TDP1MAOAMAOBMEN1GAA
SCHEMBL14136077 0.84 TDP1 (0.61) TDP1MAOAMAOBMEN1GAA
SCHEMBL14723706 0.81 TDP1 (0.66) TDP1MAOAMAOBMEN1GAA
SCHEMBL25956630 0.81 MAOA (0.48) TDP1MAOAMAOBMEN1GAA
SCHEMBL16274544 0.80 TDP1 (0.56) TDP1MAOAMAOBMEN1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240342340-A1 MULTILAYER STRUCTURE USING CHEMICALLY CROSSLINKED ALGINIC ACID MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2024-10-17 US disclosed
US-20230035986-A1 NOVEL CROSSLINKED ALGINIC ACID MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2023-02-02 US disclosed
WO-2022145419-A1 MULTILAYER STRUCTURE USING CHEMICALLY CROSSLINKED ALGINIC ACID 持田製薬株式会社 2022-07-07 WO disclosed
WO-2021125255-A1 NOVEL CROSSLINKED ALGINIC ACID 持田製薬株式会社 2021-06-24 WO disclosed
WO-2021125279-A1 CHEMICALLY CROSSLINKED ALGINATE GEL FIBER 持田製薬株式会社 2021-06-24 WO disclosed