SCHEMBL22728284

SCHEMBL22728284

CCC(C#N)(CC)Cc1cc(F)cc(F)c1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ IDO1 P14902 2/20 0.32

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
SCHEMBL22728296 0.90 THRB (0.32) —
SCHEMBL22728291 0.81 LMNA (0.37) IDO1
SCHEMBL22728287 0.79 RIPK1 (0.37) —
SCHEMBL22728363 0.77 RIPK1 (0.40) —
SCHEMBL22728383 0.72 CTSS (0.42) —
SCHEMBL22728334 0.72 RIPK1 (0.41) IDO1
SCHEMBL14307073 0.71 IDO1 (0.37) IDO1
SCHEMBL22728328 0.69 HTR2A (0.47) IDO1
Acetonitrile SCHEMBL29275405 0.68 CA12 (0.42) IDO1
SCHEMBL22728398 0.68 PNMT (0.43) IDO1

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
WO-2020243027-A1 COMPOUNDS, COMPOSITIONS, AND METHODS OF USE SAGE THERAPEUTICS, INC. (US) 2020-12-03 — — WO disclosed
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