SCHEMBL6986333

SCHEMBL6986333

CC(C)(CNC(=O)c1cccc(Cl)c1)CNc1c(Nc2cccnc2)c(=O)c1=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
BRAF P15056 1/20 0.46
CSF1R P07333 1/20 0.46
NPC1 O15118 3/20 0.45
GAA P10253 1/20 0.44
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
GRM5 P41594 3/20 0.43
ALDH1A1 P00352 1/20 0.43
MAPT P10636 1/20 0.43
ABCC9 O60706 1/20 0.43
ABCC8 Q09428 1/20 0.43
KCNJ11 Q14654 1/20 0.43
KCNJ8 Q15842 1/20 0.43
CXCR3 P49682 1/20 0.42
TBXA2R P21731 1/20 0.42
TBXAS1 P24557 1/20 0.42
POLB P06746 1/20 0.41
CSNK2A2 P19784 1/20 0.40

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 0.92 CSF1R (0.44) MEN1KMT2ABRAFCSF1RNPC1
SCHEMBL4367794 0.90 GRM5 (0.45) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL6981925 0.89 NAMPT (0.50) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL6988714 0.89 SIRT2 (0.43) MEN1KMT2ARAB9AALDH1A1TBXA2R
SCHEMBL6987131 0.89 GRM5 (0.44) MEN1KMT2ACSF1RNPC1SMN1; SMN2
SCHEMBL6988050 0.88 ALPL (0.43) MEN1KMT2AGAARAB9ASMN1; SMN2
SCHEMBL6990616 0.86 KMT2A (0.50) MEN1KMT2ANPC1GAARAB9A
SCHEMBL6988688 0.85 ABCC9 (0.41) BRAFNPC1RAB9AABCC9ABCC8
SCHEMBL6988180 0.84 NAMPT (0.51) KMT2ANPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL6989487 0.83 ALDH1A1 (0.49) MEN1KMT2AGAARAB9ASMN1; SMN2

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 4 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 claimed
WO-2002062761-A1 AMINAL DIONES AS POTASSIUM CHANNEL OPENERS ABBOTT LABORATORIES (US) 2002-08-15 WO claimed
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