Azepane

Azepane

SCHEMBL3969610

C1CCCNCC1.[O-][N+]12CCCCC1C2

nearest known ligand 0.36

Full drug profile on Sugi Atlas →

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36

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
SCHEMBL5744600 0.74 ALDH1A1 (0.30) ALDH1A1
SCHEMBL6130363 0.73
SCHEMBL3478339 0.73
SCHEMBL2775188 0.72
SCHEMBL32690230 0.70
Hydrochloric Acid SCHEMBL3270765 0.70
SCHEMBL6443684 0.68 ALDH1A1 (0.36) ALDH1A1
SCHEMBL7593398 0.68
SCHEMBL6103838 0.68
SCHEMBL3098043 0.67

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-2009049018-A1 NOVEL COMPOUNDS AND METHODS OF USING THEM SYNDAX PHARMACEUTICALS, INC. (US) 2009-04-16 WO disclosed