SCHEMBL28302159

SCHEMBL28302159

CC(C)(C)C(=O)C(N)C1CNCCO1

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 6/20 0.37
SLC6A2 P23975 6/20 0.35
SLC6A4 P31645 5/20 0.35
SLC6A3 Q01959 3/20 0.32

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
SCHEMBL7299084 0.80 SLC6A2 (0.36) SSTR4SLC6A2SLC6A4SLC6A3
SCHEMBL25371901 0.80 SLC6A2 (0.36) SSTR4SLC6A2SLC6A4SLC6A3
SCHEMBL15049656 0.80 SLC6A2 (0.38) SLC6A2SLC6A4SLC6A3
SCHEMBL15049657 0.80 SLC6A2 (0.38) SLC6A2SLC6A4SLC6A3
SCHEMBL9398208 0.71 SLC6A2 (0.37) SSTR4SLC6A2SLC6A4SLC6A3
SCHEMBL185652 0.71
SCHEMBL197401 0.71
Lactic Acid SCHEMBL4337806 0.71 SLC6A2 (0.38) SLC6A2SLC6A4SLC6A3
SCHEMBL3465229 0.71 SLC6A2 (0.36) SSTR4SLC6A2SLC6A4SLC6A3
SCHEMBL23929455 0.70

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-106414432-B Optionally substituted quinoline compounds 卫材R&D管理有限公司 2019-06-14 CN disclosed