SCHEMBL5586223

SCHEMBL5586223

CCS(=O)(=O)Nc1cc(N2CCCN(C(=O)OC(C)(C)C)CC2)ccc1NS(=O)(=O)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 8/20 0.50
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
GAA P10253 1/20 0.44
PDK2 Q15119 1/20 0.44
CKS1B P61024 1/20 0.44
SKP1 P63208 1/20 0.44
SKP2 Q13309 1/20 0.44
NAMPT P43490 1/20 0.44
PIK3CA P42336 1/20 0.44
BCL2 P10415 1/20 0.44
BCL2L1 Q07817 1/20 0.44
GPR119 Q8TDV5 1/20 0.44
KEAP1 Q14145 1/20 0.43
NFE2L2 Q16236 1/20 0.43
P2RX7 Q99572 1/20 0.42

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
SCHEMBL3619817 0.95 TGFBR1 (0.52) TGFBR1MEN1KMT2AGAAPDK2
SCHEMBL3613446 0.91 TGFBR1 (0.49) TGFBR1MEN1KMT2AGAAPDK2
SCHEMBL3622976 0.86 TGFBR1 (0.50) TGFBR1MEN1KMT2AGAAPDK2
SCHEMBL3616980 0.86 TGFBR1 (0.50) TGFBR1MEN1KMT2AGAAPDK2
SCHEMBL3621035 0.84 BCL2 (0.52) TGFBR1MEN1KMT2AGAABCL2
SCHEMBL3615524 0.83 TGFBR1 (0.49) TGFBR1MEN1KMT2AGAAPDK2
SCHEMBL3613583 0.83 TGFBR1 (0.47) TGFBR1MEN1KMT2AGAAPDK2
SCHEMBL3622518 0.82 TGFBR1 (0.53) TGFBR1MEN1KMT2AGAAPDK2
SCHEMBL3618644 0.78 TGFBR1 (0.51) TGFBR1MEN1KMT2APDK2PIK3CA
SCHEMBL6744636 0.77 HTR6 (0.66) TGFBR1MEN1KMT2APDK2NAMPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7173035-B2 Arylsulfonamide compounds BIOVITRUM AB (SE) 2007-02-06 US disclosed