SCHEMBL6981925

SCHEMBL6981925

CC(C)(CNC(=O)c1ccc(Cl)cc1)CNc1c(Nc2cccnc2)c(=O)c1=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 6/20 0.50
CYP11B1 P15538 1/20 0.50
CYP11B2 P19099 1/20 0.50
ABCC9 O60706 4/20 0.46
ABCC8 Q09428 4/20 0.46
KCNJ11 Q14654 4/20 0.46
KCNJ8 Q15842 4/20 0.46
KMT2A Q03164 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
MEN1 O00255 2/20 0.44
LMNA P02545 2/20 0.44
KDM4E B2RXH2 1/20 0.44
MAPT P10636 1/20 0.44
MAPK1 P28482 1/20 0.44
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
HTT P42858 1/20 0.42
TSHR P16473 1/20 0.42
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 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
SCHEMBL6990458 0.91 CSF1R (0.44) NAMPTCYP11B1CYP11B2KMT2AMEN1
SCHEMBL6988180 0.91 NAMPT (0.51) NAMPTKMT2ASMN1; SMN2LMNAMAPT
SCHEMBL6986333 0.89 MEN1 (0.48) ABCC9ABCC8KCNJ11KCNJ8KMT2A
SCHEMBL6985933 0.89 CYP11B1 (0.51) NAMPTCYP11B1CYP11B2ABCC9ABCC8
SCHEMBL6990861 0.85 CYP11B1 (0.56) NAMPTCYP11B1CYP11B2ABCC9ABCC8
SCHEMBL6988688 0.85 ABCC9 (0.41) NAMPTCYP11B1CYP11B2ABCC9ABCC8
SCHEMBL7163637 0.85 NAMPT (0.46) NAMPTCYP11B1CYP11B2ABCC9ABCC8
SCHEMBL6987131 0.83 GRM5 (0.44) KMT2ASMN1; SMN2MEN1LMNAMAPT
SCHEMBL6988714 0.83 SIRT2 (0.43) KMT2AMEN1RAB9A
SCHEMBL6989487 0.83 ALDH1A1 (0.49) KMT2ASMN1; SMN2MEN1LMNAKDM4E

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