SCHEMBL28618199

SCHEMBL28618199

CCC1CN(C(=O)O)CCC1C(=O)N(C)OC

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.33
▸ GAA P10253 1/20 0.32
▸ KDM2B Q8NHM5 6/20 0.31
▸ NEK2 P51955 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
SCHEMBL17913712 0.90 KDM2B (0.35) MAPTGAAKDM2B
SCHEMBL23825855 0.83 JAK2 (0.40) MAPT
SCHEMBL16411910 0.82 PDK2 (0.39) —
SCHEMBL17913786 0.82 KDM2B (0.36) MAPTKDM2B
SCHEMBL14699492 0.79 KDM2B (0.30) KDM2B
SCHEMBL17913787 0.79 KDM2B (0.37) MAPTKDM2B
SCHEMBL17913745 0.78 KDM2B (0.31) KDM2B
SCHEMBL969838 0.77 SMN1; SMN2 (0.38) MAPTGAA
SCHEMBL586633 0.77 SMN1; SMN2 (0.38) MAPTGAA
SCHEMBL895391 0.77 SMN1; SMN2 (0.38) MAPTGAA

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-113302184-A 1,3, 4-oxadiazolinone compounds and drugs 日本新药株式会社 2021-08-24 — — CN disclosed
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