SCHEMBL6918252

SCHEMBL6918252

[Fe]c1cc(CC=Nc2ccccc2)nc(CC=Nc2ccccc2)c1

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.33

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
SCHEMBL15054528 0.82 KCNH2 (0.41) MAOA
SCHEMBL18544049 0.73 KCNH2 (0.37)
SCHEMBL6243528 0.71 MAOA (0.50) MAOA
SCHEMBL18543986 0.71 BACE1 (0.33)
SCHEMBL12136378 0.69 MAOB (0.50) MAOA
SCHEMBL2342516 0.69 MAOB (0.50) MAOA
SCHEMBL18947039 0.69 MAOB (0.50) MAOA
SCHEMBL18544054 0.68 BACE1 (0.33)
SCHEMBL21239584 0.68 HTR3E (0.40)
SCHEMBL10090559 0.68 ALDH1A1 (0.45) MAOA

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
WO-2004067586-A2 MIXED BIMETALLIC OLEFIN POLYMERISATION CATALYST SAFETEC GMBH (DE) 2004-08-12 WO disclosed