SCHEMBL29116406

SCHEMBL29116406

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

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ NEU2 Q9Y3R4 3/20 0.38
▸ NEU4 Q8WWR8 2/20 0.31
▸ NEU3 Q9UQ49 2/20 0.31
▸ NEU1 Q99519 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
SCHEMBL15662367 1.00 NEU2 (0.38) NEU2NEU4NEU3NEU1
SCHEMBL15658717 1.00 NEU2 (0.38) NEU2NEU4NEU3NEU1
SCHEMBL28047334 0.89 PDE4A (0.41) NEU2NEU4NEU3NEU1
SCHEMBL15661267 0.89 PDE4A (0.41) NEU2NEU4NEU3NEU1
SCHEMBL15661773 0.89 PDE4A (0.41) NEU2NEU4NEU3NEU1
SCHEMBL28887212 0.81 NEU2 (0.39) NEU2NEU4NEU3NEU1
SCHEMBL29640110 0.81 NEU2 (0.39) NEU2NEU4NEU3NEU1
SCHEMBL29640216 0.81 NEU2 (0.39) NEU2NEU4NEU3NEU1
SCHEMBL25790219 0.79 NEU2 (0.34) NEU2NEU4NEU3
SCHEMBL15879687 0.73 LMNA (0.33) NEU2NEU4NEU3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116917323-A Antibody-drug conjugates targeting B7H4 and methods of use thereof 梅尔莎纳医疗公司 2023-10-20 — — CN disclosed
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