SCHEMBL25945329

SCHEMBL25945329

CC(F)(F)c1ccn(CC2CC3(CNC3)C2)c(=O)c1

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GRIA2 P42262 1/20 0.33
GRIN2A Q12879 1/20 0.33
CHEK1 O14757 1/20 0.33
FLT3 P36888 1/20 0.33
DRD2 P14416 1/20 0.31
DRD3 P35462 1/20 0.31

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
SCHEMBL25146047 0.90 GRM2 (0.35) GRIA2GRIN2ACHEK1FLT3DRD2
SCHEMBL30775960 0.79 GRIA2 (0.30) GRIA2GRIN2A
SCHEMBL30775994 0.73 TDP1 (0.43)
SCHEMBL30410253 0.71 ABHD6 (0.42)
SCHEMBL25146035 0.70 GRM2 (0.42) GRIA2GRIN2ADRD2
SCHEMBL31532472 0.68 DRD3 (0.33) DRD2DRD3
SCHEMBL30408375 0.68 MGLL (0.42)
SCHEMBL25327092 0.67 GRIA1 (0.33) CHEK1FLT3
SCHEMBL31532468 0.65
SCHEMBL31104604 0.64 CHEK1 (0.32) CHEK1FLT3

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-2023144160-A1 NEW HETEROCYCLIC COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2023-08-03 WO disclosed