SCHEMBL29636008

SCHEMBL29636008

Cc1cc(Cn2c(=O)n(C)c3ncc(Br)cc32)no1

nearest known ligand 0.65

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 12/20 0.65
GRIN2B Q13224 12/20 0.65
HSD17B10 Q99714 1/20 0.56
TRPA1 O75762 3/20 0.50
PARG Q86W56 2/20 0.44
GABRA5 P31644 2/20 0.43
GABRA1 P14867 1/20 0.43

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
SCHEMBL20129922 1.00 GRIN1 (0.65) GRIN1GRIN2BHSD17B10TRPA1PARG
SCHEMBL28736749 0.81 GRIN2B (0.53) GRIN1GRIN2BTRPA1GABRA5GABRA1
SCHEMBL31008704 0.81 GRIN2B (0.53) GRIN1GRIN2BTRPA1GABRA5GABRA1
SCHEMBL20129925 0.80 GRIN1 (0.66) GRIN1GRIN2BHSD17B10TRPA1PARG
SCHEMBL25253002 0.79 GRIN1 (0.57) GRIN1GRIN2BTRPA1PARGGABRA5
SCHEMBL20130187 0.79 GRIN1 (1.00) GRIN1GRIN2B
SCHEMBL20129962 0.78 GRIN1 (1.00) GRIN1GRIN2B
SCHEMBL20129960 0.78 GRIN1 (1.00) GRIN1GRIN2B
SCHEMBL31008724 0.78 GRIN1 (0.62) GRIN1GRIN2BHSD17B10PARG
SCHEMBL20129924 0.78 GRIN1 (0.62) GRIN1GRIN2BHSD17B10PARG

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 3 patents. 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
CN-114989164-A Substituted 1H-imidazo [4,5-b ] pyridin-2 (3H) -ones and uses thereof 詹森药业有限公司 2022-09-02 CN disclosed
CN-110062761-B Substituted 1H-imidazo [4,5-b ] pyridin-2 (3H) -ones and uses thereof 詹森药业有限公司 2022-05-13 CN disclosed