SCHEMBL6983249

SCHEMBL6983249

CC(C)(CNC(=O)c1cccc(Cl)c1)CNc1c(Nc2cccnc2Cl)c(=O)c1=O

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.44
MEN1 O00255 4/20 0.44
L3MBTL1 Q9Y468 1/20 0.43
POLB P06746 2/20 0.39
KCNH2 Q12809 1/20 0.39
CACNA1I Q9P0X4 1/20 0.39
GFER P55789 1/20 0.39
GRM5 P41594 2/20 0.39
RAB9A P51151 3/20 0.39
NPC1 O15118 2/20 0.39
ALDH1A1 P00352 2/20 0.38
MAPK1 P28482 1/20 0.38
HTT P42858 1/20 0.38
CACNA1H O95180 1/20 0.37
LMNA P02545 1/20 0.37

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
SCHEMBL6981005 0.92 POLB (0.42) KMT2AMEN1L3MBTL1POLBKCNH2
SCHEMBL6985151 0.92 KMT2A (0.55) KMT2AMEN1L3MBTL1POLBRAB9A
SCHEMBL6991687 0.91 KMT2A (0.42) KMT2AMEN1POLBRAB9ANPC1
SCHEMBL6988211 0.87 POLB (0.40) KMT2AMEN1L3MBTL1POLBRAB9A
SCHEMBL6986333 0.83 MEN1 (0.48) KMT2AMEN1POLBKCNH2CACNA1I
SCHEMBL6990616 0.82 KMT2A (0.50) KMT2AMEN1POLBGRM5RAB9A
SCHEMBL4367794 0.81 GRM5 (0.45) KMT2AMEN1KCNH2CACNA1IGRM5
SCHEMBL6989465 0.80 NPC1 (0.41) KMT2AMEN1L3MBTL1POLBRAB9A
SCHEMBL6983246 0.78 KMT2A (0.44) KMT2AMEN1L3MBTL1POLBGRM5
SCHEMBL6990394 0.77 NPC1 (0.40) KMT2AMEN1RAB9ANPC1ALDH1A1

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-1358160-A1 AMINAL DIONES AS POTASSIUM CHANNEL OPENERS Abbott Laboratories (US) 2003-11-05 EP disclosed
WO-2002062761-A1 AMINAL DIONES AS POTASSIUM CHANNEL OPENERS ABBOTT LABORATORIES (US) 2002-08-15 WO disclosed