SCHEMBL5307608

SCHEMBL5307608

CC(=O)N1CCN(S(=O)(=O)c2ccc(Br)cn2)CC1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.47
HSD17B10 Q99714 2/20 0.47
GAA P10253 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
MEN1 O00255 4/20 0.45
KMT2A Q03164 4/20 0.45
KDM4E B2RXH2 1/20 0.44
GPR183 P32249 1/20 0.41
LSS P48449 2/20 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
SCHEMBL16990245 0.83 ABL1 (0.44) ALDH1A1HSD17B10KMT2AKDM4E
SCHEMBL4262633 0.82 LMNA (0.50) ALDH1A1HSD17B10L3MBTL1MEN1KMT2A
SCHEMBL16990306 0.82 TGM2 (0.52) HSD17B10KDM4E
SCHEMBL2992907 0.80 USP2 (0.46) ALDH1A1GAAKDM4E
SCHEMBL2836564 0.79 KMT2A (0.62) ALDH1A1GAAMEN1KMT2AGPR183
SCHEMBL5309526 0.77 ALDH1A1 (0.59) ALDH1A1HSD17B10GAAL3MBTL1MEN1
SCHEMBL12751738 0.77 HTT (0.52) ALDH1A1L3MBTL1MEN1KMT2A
SCHEMBL26983350 0.76 LMNA (0.52) ALDH1A1GAAL3MBTL1MEN1KMT2A
SCHEMBL3636698 0.76 L3MBTL1 (0.42) ALDH1A1L3MBTL1KDM4E
SCHEMBL1433065 0.75 AKR1C3 (0.66) ALDH1A1HSD17B10GAAL3MBTL1MEN1

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
WO-2007039580-A1 IMIDAZOLYL-SUBSTITUTED BENZOPHENONE COMPOUNDS NYCOMED GMBH (DE) 2007-04-12 WO disclosed