SCHEMBL12320194

SCHEMBL12320194

NC[C@@H]1CCN([C@@H]2Cc3ccccc3[C@H]2Oc2ccc(N=O)cc2)C1

nearest known ligand 0.50

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ SLC9A3 P48764 19/20 0.50
▸ TRPC6 Q9Y210 1/20 0.50
▸ CYP2D6 P10635 2/20 0.43

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
SCHEMBL14966575 0.87 TRPC6 (0.52) SLC9A3TRPC6CYP2D6
SCHEMBL14966618 0.87 TRPC6 (0.52) SLC9A3TRPC6CYP2D6
SCHEMBL12291653 0.87 TRPC6 (0.52) SLC9A3TRPC6CYP2D6
SCHEMBL2409077 0.87 TRPC6 (0.52) SLC9A3TRPC6CYP2D6
SCHEMBL2409863 0.87 TRPC6 (0.52) SLC9A3TRPC6CYP2D6
SCHEMBL12320495 0.87 TRPC6 (0.52) SLC9A3TRPC6CYP2D6
SCHEMBL2410171 0.87 TRPC6 (0.52) SLC9A3TRPC6CYP2D6
SCHEMBL2411532 0.85 SLC9A3 (0.50) SLC9A3TRPC6CYP2D6
SCHEMBL2408231 0.85 SLC9A3 (0.50) SLC9A3TRPC6CYP2D6
SCHEMBL12363441 0.82 TRPC6 (0.47) SLC9A3TRPC6CYP2D6

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-2368876-A1 Derivatives of aminoindanes, their preparation and their application in therapeutics SANOFI (FR) 2011-09-28 — — EP disclosed
Send feedback