SCHEMBL29034249

SCHEMBL29034249

N#CCc1cccnc1C1CNCCO1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.37
DRD3 P35462 1/20 0.37
PRKACA P17612 1/20 0.37
PRKACG P22612 1/20 0.37
PRKACB P22694 1/20 0.37
SLC6A3 Q01959 1/20 0.35
KCNH2 Q12809 1/20 0.35
TAAR1 Q96RJ0 1/20 0.35

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
SCHEMBL28257239 0.83 DRD2 (0.43) DRD2DRD3
SCHEMBL29034235 0.79 KDM4E (0.43) DRD2DRD3SLC6A3KCNH2TAAR1
SCHEMBL28666083 0.76 DRD2 (0.50) DRD2DRD3
SCHEMBL28105993 0.75 DRD2 (0.42) DRD2DRD3
SCHEMBL27816652 0.75 DRD2 (0.42) DRD2DRD3PRKACAPRKACGPRKACB
SCHEMBL28860435 0.74 DRD2 (0.41) DRD2DRD3SLC6A3
SCHEMBL8139122 0.74 SLC6A3 (0.39) SLC6A3KCNH2TAAR1
SCHEMBL8152385 0.74 HTR7 (0.42) DRD2DRD3
SCHEMBL28029236 0.73 ADRA2C (0.52) SLC6A3
SCHEMBL1665692 0.72 DRD2 (0.40) DRD2DRD3

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-116234800-A Copper complexes for the treatment of neurodegenerative disorders ALS治疗发展学会 2023-06-06 CN disclosed