SCHEMBL20210796

SCHEMBL20210796

CN1CC(NC(=O)C(Cl)(Cl)c2ccc(-c3ccsc3)c(NC(=O)Nc3cccc(C(F)(F)F)c3)c2)C1

nearest known ligand 0.71

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ IDH2 P48735 20/20 0.71

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
SCHEMBL18458138 0.92 IDH2 (0.83) IDH2
SCHEMBL20210806 0.89 IDH2 (0.85) IDH2
SCHEMBL20210798 0.89 IDH2 (0.72) IDH2
SCHEMBL20210805 0.85 IDH2 (0.69) IDH2
SCHEMBL20210797 0.83 IDH2 (0.68) IDH2
SCHEMBL18458151 0.83 IDH2 (1.00) IDH2
SCHEMBL18458318 0.83 IDH2 (1.00) IDH2
SCHEMBL20210795 0.82 IDH2 (0.72) IDH2
SCHEMBL18458303 0.81 IDH2 (0.86) IDH2
SCHEMBL18458302 0.81 IDH2 (1.00) IDH2

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-3330263-A1 ANTITUMOR COMPOUND TARGETING IDH2 MUTATION AND METHOD OF USE THEREOF Chia Tai Tianqing Pharmaceutical Group Co.,Ltd (CN) 2018-06-06 — — EP disclosed
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