SCHEMBL31467487

SCHEMBL31467487

CC(CN)N1CC(C)(C)c2ccccc21

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 8/20 0.48
SLC6A4 P31645 8/20 0.48
NOTUM Q6P988 1/20 0.44
CNR2 P34972 1/20 0.40
HTR2A P28223 1/20 0.39
HTR2C P28335 1/20 0.35
BIRC2 Q13490 1/20 0.34
SLC6A3 Q01959 2/20 0.33
HTR3E A5X5Y0 1/20 0.33
HTR3B O95264 1/20 0.33
HTR3A P46098 1/20 0.33
HTR3D Q70Z44 1/20 0.33
HTR3C Q8WXA8 1/20 0.33

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
SCHEMBL20250802 0.85 SLC6A2 (0.49) SLC6A2SLC6A4NOTUMCNR2HTR2C
SCHEMBL2625762 0.81 SLC6A2 (0.50) SLC6A2SLC6A4NOTUMCNR2HTR2C
Iodide SCHEMBL29267965 0.80 SLC6A2 (0.49) SLC6A2SLC6A4NOTUMCNR2HTR2C
SCHEMBL13209528 0.76 SLC6A2 (0.50) SLC6A2SLC6A4NOTUMCNR2HTR2C
SCHEMBL16685072 0.76 SLC6A2 (0.53) SLC6A2SLC6A4NOTUMCNR2SLC6A3
SCHEMBL5848485 0.75 SLC6A2 (0.56) SLC6A2SLC6A4NOTUMCNR2HTR2C
SCHEMBL16684820 0.74 SLC6A2 (0.45) SLC6A2SLC6A4NOTUMCNR2HTR2C
SCHEMBL15523054 0.73 NOTUM (0.40) SLC6A2SLC6A4NOTUMHTR2AHTR2C
SCHEMBL16685074 0.72 SLC6A2 (0.49) SLC6A2SLC6A4NOTUMCNR2HTR2C
SCHEMBL5472708 0.71 SLC6A2 (0.76) SLC6A2SLC6A4SLC6A3

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-2025049643-A1 NOX4 INHIBITORS AND METHODS OF MAKING AND USING SAME THE UNITED STATES GOVERNMENT AS REPRESENTED BY THE DEPARTMENT OF VETERANS AFFAIRS (US) 2025-03-06 WO disclosed