SCHEMBL29635511

SCHEMBL29635511

O=C(Cn1c(=O)[nH]c2ncc(-c3cccc(C(F)(F)F)c3)cc21)NC1CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 20/20 1.00
GRIN2B Q13224 20/20 1.00

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
SCHEMBL20134147 1.00 GRIN1 (1.00) GRIN1GRIN2B
SCHEMBL20134204 0.96 GRIN1 (1.00) GRIN1GRIN2B
SCHEMBL29887498 0.96 GRIN1 (1.00) GRIN1GRIN2B
SCHEMBL20134032 0.96 GRIN1 (1.00) GRIN1GRIN2B
SCHEMBL20134177 0.92 GRIN1 (1.00) GRIN1GRIN2B
SCHEMBL20134194 0.91 GRIN1 (1.00) GRIN1GRIN2B
SCHEMBL29887663 0.91 GRIN1 (1.00) GRIN1GRIN2B
SCHEMBL20134261 0.87 GRIN1 (1.00) GRIN1GRIN2B
SCHEMBL29635434 0.87 GRIN1 (1.00) GRIN1GRIN2B
SCHEMBL20134260 0.87 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 claimed