SCHEMBL28047334

SCHEMBL28047334

[N-]=[N+]=NCC(=O)NC(=O)C(O)C(O)C(O)C(O)CO

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PDE4A P27815 1/20 0.41
▸ LMNA P02545 2/20 0.39
▸ NEU2 Q9Y3R4 2/20 0.37
▸ NEU4 Q8WWR8 1/20 0.37
▸ NEU1 Q99519 1/20 0.37
▸ NEU3 Q9UQ49 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.32
▸ USP2 O75604 1/20 0.32
▸ SLCO1B1 Q9Y6L6 1/20 0.32
▸ KDM4E B2RXH2 2/20 0.30

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
SCHEMBL15661267 1.00 PDE4A (0.41) PDE4ALMNANEU2NEU4NEU1
SCHEMBL15661773 1.00 PDE4A (0.41) PDE4ALMNANEU2NEU4NEU1
SCHEMBL29116406 0.89 NEU2 (0.38) NEU2NEU4NEU1NEU3
SCHEMBL15662367 0.89 NEU2 (0.38) NEU2NEU4NEU1NEU3
SCHEMBL15658717 0.89 NEU2 (0.38) NEU2NEU4NEU1NEU3
SCHEMBL28887069 0.81 NEU2 (0.39) PDE4ALMNANEU2NEU4NEU1
SCHEMBL4862153 0.77 PDE4A (0.48) PDE4ALMNAL3MBTL1TDP1USP2
SCHEMBL30407499 0.76 LMNA (0.46) PDE4ALMNANEU2NEU4NEU1
SCHEMBL18209366 0.74 PDE4A (0.46) PDE4ALMNAL3MBTL1TDP1USP2
SCHEMBL29171639 0.74 PDE4A (0.48) PDE4ALMNAL3MBTL1TDP1USP2

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-116925228-A Modified PD-1 antibody and preparation method and application thereof 苏州大学 2023-10-24 — — CN disclosed
CN-108883191-B Antibody-conjugates with improved therapeutic index for targeting CD30 tumors and methods for improving the therapeutic index of antibody-conjugates 西纳福克斯股份有限公司 2022-10-14 — — CN disclosed
CN-113943330-A Sugar-containing structure compound, preparation method, pharmaceutical composition and application thereof 中国科学院上海药物研究所 2022-01-18 — — CN disclosed
CN-105142672-A Modified antibodies, antibody-conjugates and methods of making the same SYNAFFIX BV 2015-12-09 — — CN disclosed
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