SCHEMBL6246512

SCHEMBL6246512

CN(C(=O)OC(C)(C)C)[C@H]1CC[C@@H](c2ccc(Cl)c(Cl)c2)c2ccc(NS(C)(=O)=O)cc21

nearest known ligand 0.59

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 16/20 0.59
SLC6A2 P23975 14/20 0.59
SLC6A3 Q01959 14/20 0.59
NR3C1 P04150 1/20 0.42

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
SCHEMBL6246514 1.00 SLC6A4 (0.59) SLC6A4SLC6A2SLC6A3NR3C1
SCHEMBL6246517 1.00 SLC6A4 (0.59) SLC6A4SLC6A2SLC6A3NR3C1
SCHEMBL6247955 0.85 SLC6A4 (0.50) SLC6A4SLC6A2SLC6A3
SCHEMBL6245138 0.85 SLC6A4 (0.64) SLC6A4SLC6A2SLC6A3
SCHEMBL6247961 0.85 SLC6A4 (0.50) SLC6A4SLC6A2SLC6A3
SCHEMBL6245136 0.85 SLC6A4 (0.64) SLC6A4SLC6A2SLC6A3
SCHEMBL6247959 0.85 SLC6A4 (0.50) SLC6A4SLC6A2SLC6A3
SCHEMBL6245132 0.85 SLC6A4 (0.64) SLC6A4SLC6A2SLC6A3
SCHEMBL6248482 0.85 SLC6A4 (0.42) SLC6A4SLC6A2SLC6A3
SCHEMBL6248480 0.85 SLC6A4 (0.42) SLC6A4SLC6A2SLC6A3

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
EP-1157002-B1 1,2,3,4-TETRAHYDRO-1-NAPHTHALENAMINE COMPOUNDS USEFUL IN THERAPY PFIZER LTD (GB) 2005-08-10 EP disclosed