SCHEMBL6983720

SCHEMBL6983720

CC(C)(CNC(=O)c1cccc(Cl)c1)C(Nc1c(Nc2cccnc2)c(=O)c1=O)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPKAPK2 P49137 3/20 0.49
MEN1 O00255 4/20 0.43
KMT2A Q03164 4/20 0.43
POLB P06746 1/20 0.42
BRAF P15056 1/20 0.42
CSF1R P07333 1/20 0.41
ABCC9 O60706 1/20 0.41
ABCC8 Q09428 1/20 0.41
KCNJ11 Q14654 1/20 0.41
KCNJ8 Q15842 1/20 0.41
GPR139 Q6DWJ6 2/20 0.41
ATM Q13315 1/20 0.41
NPC1 O15118 2/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
LMNA P02545 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41
TSHR P16473 1/20 0.41
TBXA2R P21731 1/20 0.40
TBXAS1 P24557 1/20 0.40
USP2 O75604 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
SCHEMBL6989503 0.93 MAPKAPK2 (0.49) MAPKAPK2MEN1KMT2ACSF1RGPR139
SCHEMBL6985543 0.91 MAPKAPK2 (0.50) MAPKAPK2MEN1KMT2ABRAFCSF1R
SCHEMBL6988227 0.86 MAPKAPK2 (0.49) MAPKAPK2ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL6986333 0.82 MEN1 (0.48) MEN1KMT2APOLBBRAFCSF1R
SCHEMBL6983717 0.80 MAPKAPK2 (0.46) MAPKAPK2MEN1KMT2ABRAFCSF1R
SCHEMBL6984652 0.79 ABCC9 (0.51) MAPKAPK2MEN1KMT2ABRAFCSF1R
SCHEMBL6988592 0.79 KCNJ11 (0.54) MAPKAPK2MEN1KMT2ABRAFCSF1R
SCHEMBL6984659 0.78 ABCC9 (0.47) MAPKAPK2MEN1KMT2ABRAFCSF1R
SCHEMBL6989571 0.78 KMT2A (0.50) MAPKAPK2MEN1KMT2APOLBGPR139
SCHEMBL6989589 0.78 CCR6 (0.44) MAPKAPK2KMT2ANPC1SMN1; SMN2RAB9A

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