SCHEMBL5322343

SCHEMBL5322343

O=C(c1ccc(-c2ccc(=O)[nH]n2)cc1)N1CCN(S(=O)(=O)c2ccc3cn[nH]c3c2)CC1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.53
L3MBTL1 Q9Y468 2/20 0.53
MAPT P10636 2/20 0.48
ATM Q13315 1/20 0.46
F10 P00742 7/20 0.46
LMNA P02545 3/20 0.44
USP2 O75604 2/20 0.44
MEN1 O00255 1/20 0.44
GAA P10253 1/20 0.44
TSHR P16473 1/20 0.44
HTT P42858 1/20 0.44
KMT2A Q03164 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
THRB P10828 1/20 0.43
MAPK1 P28482 1/20 0.42
HSD17B10 Q99714 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
SCHEMBL5326524 0.88 L3MBTL1 (0.54) ALDH1A1L3MBTL1MAPTATMF10
SCHEMBL6152346 0.84 ALDH1A1 (0.59) ALDH1A1L3MBTL1MAPTATMF10
SCHEMBL6152664 0.84 F10 (0.65) ALDH1A1L3MBTL1MAPTATMF10
SCHEMBL5326485 0.83 ALDH1A1 (0.48) ALDH1A1L3MBTL1MAPTATMF10
SCHEMBL5327745 0.83 MAPT (0.52) ALDH1A1L3MBTL1MAPTF10LMNA
SCHEMBL5323222 0.82 L3MBTL1 (0.47) ALDH1A1L3MBTL1MAPTATMF10
SCHEMBL14095701 0.77 F10 (0.50) ALDH1A1L3MBTL1MAPTATMF10
SCHEMBL4900354 0.75 F10 (0.65) F10
SCHEMBL5327115 0.72 GHSR (0.50) L3MBTL1MAPTATMF10MEN1
SCHEMBL5324846 0.72 HRH3 (0.54) L3MBTL1MAPTATMF10

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-2007008145-A1 HETEROCYCLIC SULFONAMIDE DERIVATIVES AS INHIBITORS OF FACTOR XA ASTRAZENECA AB (SE) 2007-01-18 WO disclosed