SCHEMBL30887367

SCHEMBL30887367

O=S1(=O)CCC12CCCNC2

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.30
SLC6A4 P31645 1/20 0.30
SLC6A3 Q01959 1/20 0.30

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
Hydrochloric Acid SCHEMBL19897487 0.84 SLC6A2 (0.31) SLC6A2SLC6A4SLC6A3
SCHEMBL8775581 0.84 SLC6A2 (0.36) SLC6A2SLC6A4SLC6A3
SCHEMBL31616067 0.84 SLC6A2 (0.36) SLC6A2SLC6A4SLC6A3
SCHEMBL19738983 0.83 SLC6A2 (0.30) SLC6A2SLC6A4SLC6A3
Hydrochloric Acid SCHEMBL17849004 0.81
Hydrochloric Acid SCHEMBL19717658 0.81
SCHEMBL14896629 0.79
Hydrochloric Acid SCHEMBL17891482 0.77
SCHEMBL17374728 0.75
SCHEMBL17374744 0.73

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-117897159-A Heterocyclic compounds and methods of use 安进公司 2024-04-16 CN disclosed