SCHEMBL19192530

SCHEMBL19192530

C[C@@H]1COC(=O)N1c1ccnc(Cl)n1

nearest known ligand 0.45

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
IDH1 O75874 19/20 0.45
MTOR P42345 1/20 0.43

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
SCHEMBL19692753 1.00 IDH1 (0.45) IDH1MTOR
SCHEMBL19692754 1.00 IDH1 (0.45) IDH1MTOR
SCHEMBL19179094 0.82 IDH1 (0.58) IDH1
SCHEMBL19692705 0.82 IDH1 (0.48) IDH1MTOR
SCHEMBL14831089 0.82 IDH1 (0.64) IDH1
SCHEMBL19692706 0.82 IDH1 (0.48) IDH1MTOR
SCHEMBL14831090 0.82 IDH1 (0.64) IDH1
SCHEMBL14846751 0.82 IDH1 (0.58) IDH1
SCHEMBL30324889 0.80 IDH1 (0.57) IDH1
SCHEMBL16043882 0.80 IDH1 (0.48) 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