SCHEMBL2855035

SCHEMBL2855035

CCN(/C(=N/C#N)NCCOC)C1CCC(CNC(=O)c2ccccc2OC)(c2ccccc2)CC1

nearest known ligand 0.62

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KCNA3 P22001 19/20 0.62
MEN1 O00255 1/20 0.54
ALDH1A1 P00352 1/20 0.54
KMT2A Q03164 1/20 0.54

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
SCHEMBL6222344 1.00 KCNA3 (0.62) KCNA3MEN1ALDH1A1KMT2A
SCHEMBL2864692 0.93 KCNA3 (0.57) KCNA3MEN1ALDH1A1KMT2A
SCHEMBL2857522 0.91 KCNA3 (0.60) KCNA3MEN1ALDH1A1KMT2A
SCHEMBL2864768 0.91 KCNA3 (0.60) KCNA3MEN1ALDH1A1KMT2A
SCHEMBL2861847 0.91 KCNA3 (0.62) KCNA3MEN1ALDH1A1KMT2A
SCHEMBL2864478 0.90 KCNA3 (0.61) KCNA3MEN1ALDH1A1KMT2A
SCHEMBL2863338 0.90 KCNA3 (0.61) KCNA3MEN1ALDH1A1KMT2A
SCHEMBL13067028 0.89 KCNA3 (0.56) KCNA3MEN1ALDH1A1KMT2A
SCHEMBL5353009 0.89 KCNA3 (0.56) KCNA3MEN1ALDH1A1KMT2A
SCHEMBL2855033 0.89 KCNA3 (0.56) KCNA3MEN1ALDH1A1KMT2A

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-2253328-A1 Cycloalkyl inhibitors of potassium channel function Bristol-Myers Squibb Company (US) 2010-11-24 EP disclosed