SCHEMBL2863147

SCHEMBL2863147

C=CCN=C(N)N[C@H]1CC[C@](CNC(=O)c2ccccc2OC)(c2ccccc2)CC1

nearest known ligand 0.72

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KCNA3 P22001 19/20 0.72
MEN1 O00255 1/20 0.59
ALDH1A1 P00352 1/20 0.59
KMT2A Q03164 1/20 0.59

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
SCHEMBL2863151 1.00 KCNA3 (0.72) KCNA3MEN1ALDH1A1KMT2A
SCHEMBL5353627 0.89 KCNA3 (0.75) KCNA3MEN1ALDH1A1KMT2A
SCHEMBL5353631 0.89 KCNA3 (0.75) KCNA3MEN1ALDH1A1KMT2A
SCHEMBL2863226 0.88 KCNA3 (0.74) KCNA3MEN1ALDH1A1KMT2A
SCHEMBL2863228 0.88 KCNA3 (0.74) KCNA3MEN1ALDH1A1KMT2A
SCHEMBL2860966 0.87 KCNA3 (0.77) KCNA3MEN1ALDH1A1KMT2A
SCHEMBL2860963 0.87 KCNA3 (0.77) KCNA3MEN1ALDH1A1KMT2A
SCHEMBL13066423 0.85 KCNA3 (0.80) KCNA3MEN1ALDH1A1KMT2A
SCHEMBL14491271 0.84 KCNA3 (0.72) KCNA3MEN1ALDH1A1KMT2A
SCHEMBL3898156 0.84 KCNA3 (1.00) 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 2 patents. 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
US-7202253-B2 Cycloalkyl inhibitors of potassium channel function BRISTOL-MYERS SQUIBB COMPANY (US) 2007-04-10 US disclosed