SCHEMBL4951402

SCHEMBL4951402

O=C(O)NC1CCN(CC(c2csc(Cl)c2)C2(O)CCCCC2)CC1

nearest known ligand 0.64

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 20/20 0.64
SLC6A3 Q01959 14/20 0.64
SLC6A4 P31645 10/20 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
SCHEMBL4955570 0.83 SLC6A2 (0.72) SLC6A2SLC6A3SLC6A4
SCHEMBL3987204 0.83 SLC6A2 (0.47) SLC6A2SLC6A3SLC6A4
Hydrochloric Acid SCHEMBL3952511 0.82 SLC6A2 (0.71) SLC6A2SLC6A3SLC6A4
SCHEMBL27676023 0.82 SLC6A2 (0.74) SLC6A2SLC6A3SLC6A4
SCHEMBL27672130 0.82 SLC6A2 (0.74) SLC6A2SLC6A3SLC6A4
SCHEMBL4949055 0.81 SLC6A2 (0.42) SLC6A2SLC6A3
SCHEMBL3954397 0.80 SLC6A2 (0.62) SLC6A2SLC6A3SLC6A4
SCHEMBL4953732 0.79 SLC6A2 (1.00) SLC6A2SLC6A3SLC6A4
SCHEMBL4951469 0.79 SLC6A2 (1.00) SLC6A2SLC6A3SLC6A4
SCHEMBL4956786 0.79 SLC6A2 (1.00) SLC6A2SLC6A3SLC6A4

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-7419980-B2 Fused-aryl and heteroaryl derivatives and methods of their use WYETH (US) 2008-09-02 US disclosed