SCHEMBL28484668

SCHEMBL28484668

C[C@@H]1CN(O)[C@H](C)CN1O

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.38
▸ GAA P10253 1/20 0.35
▸ TSHR P16473 2/20 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
SCHEMBL28823925 1.00 MAPT (0.38) MAPTGAATSHR
SCHEMBL28823927 1.00 MAPT (0.38) MAPTGAATSHR
SCHEMBL28902066 1.00 MAPT (0.38) MAPTGAATSHR
SCHEMBL1644953 0.92 — —
SCHEMBL16206268 0.70 — —
SCHEMBL30277117 0.67 — —
SCHEMBL19024049 0.65 — —
SCHEMBL25097096 0.62 GAA (0.31) GAA
SCHEMBL25097100 0.62 GAA (0.31) GAA
SCHEMBL25097099 0.62 GAA (0.31) GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111440155-B Chrysamide B derivative with anti-tumor activity and preparation and application thereof 兰州大学 2022-08-30 — — CN disclosed
CN-111440155-A Chrysamide B derivative with anti-tumor activity and preparation and application thereof 兰州大学 2020-07-24 — — CN disclosed
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