SCHEMBL6201042

SCHEMBL6201042

O=C(Cl)c1ccc(S(=O)(=O)N2CCOCC2)cc1

nearest known ligand 0.70

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.70
MAPK1 P28482 1/20 0.70
KMT2A Q03164 5/20 0.65
MEN1 O00255 3/20 0.65
POLB P06746 3/20 0.65
NPC1 O15118 1/20 0.61
GAA P10253 5/20 0.60
LMNA P02545 3/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
ALDH1A1 P00352 3/20 0.59
TP53 P04637 1/20 0.58

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
SCHEMBL1832768 0.85 L3MBTL1 (0.72) L3MBTL1MAPK1KMT2AMEN1POLB
SCHEMBL3343714 0.85 ALDH1A1 (0.70) MAPK1KMT2APOLBNPC1LMNA
SCHEMBL12793245 0.84 POLB (0.88) L3MBTL1MAPK1KMT2AMEN1POLB
SCHEMBL334552 0.84 ALDH1A1 (0.73) L3MBTL1MAPK1KMT2AMEN1POLB
SCHEMBL2744785 0.84 L3MBTL1 (0.70) L3MBTL1MAPK1KMT2AMEN1POLB
SCHEMBL22076808 0.83 USP2 (0.69) L3MBTL1MAPK1KMT2APOLBNPC1
SCHEMBL15773014 0.82 TSHR (0.73) MAPK1KMT2AMEN1NPC1GAA
SCHEMBL28072234 0.81 POLB (0.76) L3MBTL1MAPK1KMT2AMEN1POLB
SCHEMBL4709068 0.81 LMNA (0.74) L3MBTL1KMT2AMEN1POLBNPC1
SCHEMBL12793846 0.80 KMT2A (0.72) L3MBTL1MAPK1KMT2AMEN1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050272036-A1 Ketones ASTRAZENECA AB (SE) 2005-12-08 US disclosed
EP-1549600-A1 KETONES AstraZeneca AB (SE) 2005-07-06 EP disclosed
WO-2004011410-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2004-02-05 WO disclosed