SCHEMBL28519971

SCHEMBL28519971

CC(C)C(=O)Cn1cc(F)c2ncc(Br)cc21

nearest known ligand 0.69

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ GRIN2B Q13224 20/20 0.69

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
SCHEMBL28517005 0.84 GRIN2B (0.70) GRIN2B
SCHEMBL18363136 0.82 GRIN2B (0.69) GRIN2B
SCHEMBL18363485 0.81 GRIN2B (1.00) GRIN2B
SCHEMBL18363481 0.81 GRIN2B (1.00) GRIN2B
SCHEMBL18363466 0.80 GRIN2B (1.00) GRIN2B
SCHEMBL18363467 0.79 GRIN2B (1.00) GRIN2B
SCHEMBL21611163 0.79 GRIN2B (0.69) GRIN2B
SCHEMBL18363134 0.78 GRIN2B (0.65) GRIN2B
SCHEMBL18363464 0.78 GRIN2B (1.00) GRIN2B
SCHEMBL18363133 0.78 GRIN2B (0.70) GRIN2B

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
CN-108026094-B Substituted 4-azaindoles and their use as modulators of the GLUN2B receptor 詹森药业有限公司 2021-02-09 — — CN disclosed
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