SCHEMBL19191980

SCHEMBL19191980

CC(Nc1nccc(N2CCOC2=O)n1)c1ccc(CN2CCN(C(=O)OC(C)(C)C)C(C)(C)C2)cc1

nearest known ligand 0.54

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ IDH1 O75874 20/20 0.54

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
SCHEMBL14832248 0.86 IDH1 (0.75) IDH1
SCHEMBL14832249 0.86 IDH1 (0.75) IDH1
SCHEMBL19192624 0.85 IDH1 (0.72) IDH1
SCHEMBL19192166 0.81 IDH1 (0.55) IDH1
SCHEMBL19193207 0.81 IDH1 (0.71) IDH1
SCHEMBL19192735 0.81 IDH1 (0.71) IDH1
SCHEMBL19193155 0.80 IDH1 (0.71) IDH1
SCHEMBL19192779 0.80 IDH1 (0.62) IDH1
SCHEMBL19191449 0.80 IDH1 (0.70) IDH1
SCHEMBL19191904 0.80 IDH1 (0.71) IDH1

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
EP-2771337-B1 3-(PYRIMIDIN-4-YL)-OXAZOLIDIN-2-ONES AS INHIBITORS OF MUTANT IDH NOVARTIS AG (CH) 2017-08-02 — — EP disclosed
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