SCHEMBL17889804

SCHEMBL17889804

CCS(=O)(=O)C(C)C1CCCCN1

nearest known ligand 0.40

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 16/20 0.40
SLC6A3 Q01959 16/20 0.40
SLC6A4 P31645 15/20 0.40

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
SCHEMBL353884 0.79 SLC6A3 (0.41) SLC6A2SLC6A3SLC6A4
SCHEMBL4074990 0.73 APLNR (0.34) SLC6A2SLC6A3SLC6A4
SCHEMBL19417440 0.72 SLC6A2 (0.47) SLC6A2SLC6A3SLC6A4
SCHEMBL1547848 0.72 SLC6A2 (0.47) SLC6A2SLC6A3SLC6A4
SCHEMBL5244582 0.71
SCHEMBL19003938 0.71 SLC6A2 (0.46) SLC6A2SLC6A3SLC6A4
SCHEMBL5244648 0.71 SLC6A2 (0.46) SLC6A2SLC6A3SLC6A4
SCHEMBL12386911 0.71 SLC6A2 (0.46) SLC6A2SLC6A3SLC6A4
SCHEMBL12386910 0.71 SLC6A2 (0.46) SLC6A2SLC6A3SLC6A4
SCHEMBL14038810 0.71

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
US-20160193231-A1 RETT SYNDROME AND TREATMENTS THEREFORE RETT SYNDROME RES TRUST (US) 2016-07-07 US disclosed