SCHEMBL22787217

SCHEMBL22787217

CCn1ncc2ncc(-c3cc(F)c(F)c(F)c3)nc21

nearest known ligand 0.67

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ GRIN2B Q13224 20/20 0.67

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
SCHEMBL30952099 0.80 GRIN2B (1.00) GRIN2B
SCHEMBL22772869 0.80 GRIN2B (1.00) GRIN2B
SCHEMBL22772863 0.72 GRIN2B (1.00) GRIN2B
SCHEMBL25098948 0.69 ALDH1A1 (0.39) GRIN2B
SCHEMBL25154222 0.69 XDH (0.37) GRIN2B
SCHEMBL29489066 0.69 ALDH1A1 (0.39) GRIN2B
SCHEMBL30316641 0.69 XDH (0.41) GRIN2B
SCHEMBL22772886 0.67 GRIN2B (1.00) GRIN2B
SCHEMBL23507946 0.67 XDH (0.36) GRIN2B
SCHEMBL22772876 0.67 GRIN2B (1.00) 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
WO-2020249802-A1 SUBSTITUTED PYRAZOLO-PYRAZINES AND THEIR USE AS GLUN2B RECEPTOR MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2020-12-17 — — WO disclosed
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