SCHEMBL4031430

SCHEMBL4031430

CCNC(=N)C(NC(=O)c1ccccc1OC)C1(c2ccccc2)CCNCC1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
KCNA3 P22001 15/20 0.45
HPGD P15428 2/20 0.43
SLC6A9 P48067 1/20 0.42
TP53 P04637 1/20 0.41
GLA P06280 1/20 0.41

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
SCHEMBL2469744 0.80 KMT2A (0.45) ALDH1A1MEN1KMT2AKCNA3HPGD
SCHEMBL2699894 0.80 ALDH1A1 (0.44) ALDH1A1MEN1KMT2AKCNA3HPGD
SCHEMBL2494273 0.78 HCN4 (0.45) ALDH1A1MEN1KMT2AKCNA3HPGD
SCHEMBL2469022 0.78 ALDH1A1 (0.41) ALDH1A1MEN1KMT2AKCNA3HPGD
SCHEMBL2471493 0.78 KCNA3 (0.44) ALDH1A1MEN1KMT2AKCNA3HPGD
SCHEMBL2470694 0.77 ALDH1A1 (0.46) ALDH1A1MEN1KMT2AKCNA3HPGD
SCHEMBL2470976 0.77 KCNA3 (0.41) ALDH1A1MEN1KMT2AKCNA3HPGD
SCHEMBL2469459 0.76 SLC6A9 (0.44) ALDH1A1MEN1KMT2AKCNA3HPGD
SCHEMBL2471820 0.76 KCNA3 (0.44) ALDH1A1MEN1KMT2AKCNA3HPGD
SCHEMBL2468588 0.76 ALDH1A1 (0.39) ALDH1A1MEN1KMT2AKCNA3HPGD

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1501467-A4 HETEROCYCLO INHIBITORS OF POTASSIUM CHANNEL FUNCTION BRISTOL MYERS SQUIBB CO (US) 2009-08-19 EP disclosed
EP-1501467-A2 HETEROCYCLO INHIBITORS OF POTASSIUM CHANNEL FUNCTION Bristol-Myers Squibb Company (US) 2005-02-02 EP disclosed
WO-2003088908-A2 HETEROCYCLO INHIBITORS OF POTASSIUM CHANNEL FUNCTION BRISTOL-MYERS SQUIBB COMPANY (US) 2003-10-30 WO disclosed