SCHEMBL30701004

SCHEMBL30701004

CCC(O)n1ccc2ccccc21

nearest known ligand 0.51

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 17/20 0.51
SLC6A2 P23975 17/20 0.51

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
SCHEMBL4985392 1.00 SLC6A4 (0.51) SLC6A4SLC6A2
SCHEMBL4991130 0.86 SLC6A2 (0.56) SLC6A4SLC6A2
SCHEMBL734140 0.83 SLC6A4 (0.51) SLC6A4SLC6A2
SCHEMBL6689744 0.82 SLC6A4 (0.48) SLC6A4SLC6A2
SCHEMBL30641149 0.81 SLC6A2 (0.50) SLC6A4SLC6A2
SCHEMBL24729036 0.79 SLC6A2 (0.49) SLC6A4SLC6A2
SCHEMBL599150 0.79 SLC6A2 (0.49) SLC6A4SLC6A2
SCHEMBL30460003 0.79 SLC6A4 (0.50) SLC6A4SLC6A2
SCHEMBL1841921 0.79 SLC6A4 (0.50) SLC6A4SLC6A2
SCHEMBL8573980 0.78 SLC6A4 (0.53) SLC6A4SLC6A2

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-117229264-A Aryl Schiff base compound containing 2-aminopyrimidine structure and application thereof 辽宁大学 2023-12-15 CN disclosed