SCHEMBL28929181

SCHEMBL28929181

COCOc1cccc(C(O)CNC(=O)c2ccc[nH]2)c1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ AOC3 Q16853 1/20 0.43
▸ GAA P10253 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ NPC1 O15118 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ HTT P42858 1/20 0.38

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
SCHEMBL28928862 0.88 KDM4E (0.41) GAAKDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL28929413 0.85 GAA (0.45) GAAKDM4E
SCHEMBL28928831 0.83 KDM4E (0.42) GAAKDM4E
SCHEMBL28928845 0.82 NPC1 (0.40) GAAKDM4ENPC1RAB9A
SCHEMBL28928818 0.78 NPC1 (0.51) AOC3GAAKDM4ENPC1RAB9A
SCHEMBL28928852 0.78 GAA (0.42) GAAKDM4EL3MBTL1NPC1RAB9A
SCHEMBL28929404 0.77 NPC1 (0.62) KDM4EL3MBTL1NPC1RAB9ASMN1; SMN2
SCHEMBL15075024 0.76 AOC3 (0.45) AOC3L3MBTL1NPC1RAB9ASMN1; SMN2
SCHEMBL3070382 0.76 HIF1A (0.56) AOC3GAAKDM4EL3MBTL1RAB9A
SCHEMBL6978184 0.71 AOC3 (0.48) AOC3L3MBTL1

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-115583942-A 2-substituted 5-phenyl-oxazole derivative, preparation method thereof and application thereof as MNK (MNK) inhibitor 中国海洋大学 2023-01-10 — — CN disclosed
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