SCHEMBL25253002

SCHEMBL25253002

Cc1cc(Cn2c(=O)n(C)c3ncc(B4OC(C)(C)C(C)(C)O4)cc32)no1

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 13/20 0.57
GRIN2B Q13224 13/20 0.57
TRPA1 O75762 2/20 0.45
PARG Q86W56 2/20 0.44
GRM2 Q14416 1/20 0.39
GABRA5 P31644 2/20 0.39
GABRA1 P14867 1/20 0.39

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
SCHEMBL3516833 0.81 HSD17B10 (0.38) GRIN1GRIN2B
SCHEMBL3513272 0.79 HSD17B10 (0.50) GRIN1GRIN2B
SCHEMBL29636008 0.79 GRIN1 (0.65) GRIN1GRIN2BTRPA1PARGGABRA5
SCHEMBL20129922 0.79 GRIN1 (0.65) GRIN1GRIN2BTRPA1PARGGABRA5
SCHEMBL3514709 0.77 PIK3CA (0.39) GRIN1GRIN2BPARG
SCHEMBL30506908 0.74 NPC1 (0.35) GRIN1GRIN2B
SCHEMBL25316750 0.74 NPC1 (0.35) GRIN1GRIN2B
SCHEMBL20130187 0.73 GRIN1 (1.00) GRIN1GRIN2B
SCHEMBL20129960 0.72 GRIN1 (1.00) GRIN1GRIN2B
SCHEMBL20129962 0.72 GRIN1 (1.00) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3523311-B1 SUBSTITUTED 1H-IMIDAZO[4,5-B]PYRIDIN-2(3H)-ONES AND THEIR USE AS GLUN2B RECEPTOR MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2023-06-07 EP 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