SCHEMBL2590981

SCHEMBL2590981

CCCC[C@]1(CC)CSc2cc(CBr)c(OC)cc2[C@@H](c2ccccc2)N1

nearest known ligand 0.57

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SLC10A2 Q12908 20/20 0.57

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
SCHEMBL2589578 1.00 SLC10A2 (0.57) SLC10A2
SCHEMBL2582350 0.96 SLC10A2 (0.54) SLC10A2
SCHEMBL2581980 0.92 SLC10A2 (0.58) SLC10A2
SCHEMBL7472527 0.90 SLC10A2 (0.63) SLC10A2
SCHEMBL2581999 0.90 SLC10A2 (0.63) SLC10A2
SCHEMBL2582109 0.90 SLC10A2 (0.63) SLC10A2
SCHEMBL7472523 0.90 SLC10A2 (0.63) SLC10A2
SCHEMBL1387665 0.88 SLC10A2 (0.55) SLC10A2
SCHEMBL1387664 0.88 SLC10A2 (0.55) SLC10A2
SCHEMBL1388965 0.87 SLC10A2 (0.54) SLC10A2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2563122-B1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE LLC (US) 2016-06-08 EP disclosed
EP-2563122-A1 CHEMICAL COMPOUNDS Glaxosmithkline LLC (US) 2013-03-06 EP disclosed
WO-2011137135-A1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE LLC (US) 2011-11-03 WO disclosed