SCHEMBL20559756

SCHEMBL20559756

C[C@H](Nc1cccc(NC(=O)O)c1)c1cc2cc(Cl)c(F)cc2[nH]c1=O

nearest known ligand 0.55

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ IDH1 O75874 20/20 0.55

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
SCHEMBL20559758 1.00 IDH1 (0.55) IDH1
SCHEMBL20559477 0.92 IDH1 (0.54) IDH1
SCHEMBL17603341 0.92 IDH1 (0.54) IDH1
SCHEMBL17603322 0.90 IDH1 (0.53) IDH1
SCHEMBL20560029 0.86 IDH1 (0.56) IDH1
SCHEMBL20560028 0.86 IDH1 (0.56) IDH1
SCHEMBL20560272 0.85 IDH1 (0.63) IDH1
SCHEMBL20559858 0.85 IDH1 (0.50) IDH1
SCHEMBL20560269 0.85 IDH1 (0.63) IDH1
SCHEMBL20559955 0.85 IDH1 (0.50) 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-3194375-B1 PHENYL QUINOLINONE DERIVATIVES AS MUTANT-ISOCITRATE DEHYDROGENASE INHIBITORS FORMA THERAPEUTICS INC (US) 2018-11-21 — — EP claimed
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