SCHEMBL30882467

SCHEMBL30882467

C[C@H](O)C(=O)c1ccc2c(c1)C(F)(F)c1ccccc1-2

nearest known ligand 0.46

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 18/20 0.46

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
SCHEMBL26120453 0.80 PDK2 (0.56) PDK2
SCHEMBL30882585 0.79 PDK2 (0.48) PDK2
SCHEMBL28270044 0.75 PDK2 (0.47) PDK2
SCHEMBL30882495 0.73 PDK2 (0.52) PDK2
SCHEMBL22355348 0.73 KDM4E (0.45) PDK2
SCHEMBL14691020 0.72 PDK2 (0.57) PDK2
SCHEMBL26117162 0.70 PDK2 (0.55) PDK2
SCHEMBL26577327 0.70 PDK2 (0.55) PDK2
SCHEMBL30572166 0.70 PTPRC (0.59) PDK2
SCHEMBL26115268 0.70 PTPRC (0.59) PDK2

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-117903077-B Dihydrooxadiazinone compound and application thereof 上海超阳药业有限公司 2024-09-03 — — CN disclosed
CN-117903077-A Dihydrooxadiazinon compound and application thereof 上海超阳药业有限公司 2024-04-19 — — CN disclosed
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