SCHEMBL31008741

SCHEMBL31008741

CCC(O)Cn1c(=O)[nH]c2ncc(Br)cc21

nearest known ligand 0.62

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 20/20 0.62
GRIN2B Q13224 20/20 0.62

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
SCHEMBL28736346 1.00 GRIN1 (0.62) GRIN1GRIN2B
SCHEMBL15999458 0.82 PDE4A (0.44) GRIN1GRIN2B
SCHEMBL20134514 0.77 GRIN1 (1.00) GRIN1GRIN2B
SCHEMBL29887730 0.77 GRIN1 (1.00) GRIN1GRIN2B
SCHEMBL20134134 0.77 GRIN1 (1.00) GRIN1GRIN2B
SCHEMBL25222465 0.77 GRIN1 (1.00) GRIN1GRIN2B
SCHEMBL29636020 0.77 GRIN1 (1.00) GRIN1GRIN2B
SCHEMBL29887463 0.77 GRIN1 (1.00) GRIN1GRIN2B
SCHEMBL20134140 0.77 GRIN1 (1.00) GRIN1GRIN2B
SCHEMBL31008703 0.76 GRIN1 (0.58) GRIN1GRIN2B

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-114989164-B Substituted 1H-imidazo [4,5-b ] pyridin-2 (3H) -ones and uses thereof 詹森药业有限公司 2024-08-13 CN disclosed