SCHEMBL5280458

SCHEMBL5280458

CCn1nnc(CC(C)(C)C)c1C(Cl)(Cl)Cl

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.32
SLC9A1 P19634 1/20 0.30

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
SCHEMBL5275284 0.86
SCHEMBL5281611 0.86 SLC9A1 (0.33) SLC9A1
SCHEMBL5284531 0.85 SLC9A1 (0.32) MAOASLC9A1
SCHEMBL5284110 0.83 SLC9A1 (0.36) SLC9A1
SCHEMBL5279042 0.83 MAOA (0.34) MAOASLC9A1
SCHEMBL5275556 0.82 SLC9A1 (0.30) SLC9A1
SCHEMBL5275630 0.81 SLC9A1 (0.39) SLC9A1
SCHEMBL5274254 0.80 MAOA (0.36) MAOASLC9A1
SCHEMBL5278762 0.79
SCHEMBL5281407 0.78

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-1859781-A2 Brightening and/or colouring agent with triazoles Henkel Kommanditgesellschaft auf Aktien (DE) 2007-11-28 EP disclosed