SCHEMBL27601593

SCHEMBL27601593

CCN1CCCC1CNS(=O)(=O)c1ccc(Cl)nc1C

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.55
ATM Q13315 1/20 0.55
L3MBTL1 Q9Y468 3/20 0.47
NAMPT P43490 1/20 0.45
PIK3CD O00329 1/20 0.41
PIK3CB P42338 1/20 0.41
PIK3CG P48736 1/20 0.41
TSHR P16473 1/20 0.41
SIGMAR1 Q99720 1/20 0.41
DRD2 P14416 2/20 0.40
MEN1 O00255 1/20 0.40
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
HPGD P15428 1/20 0.39
HSD17B10 Q99714 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL4059362 0.80 ATM (0.66) KMT2AATML3MBTL1NAMPTPIK3CD
SCHEMBL2708828 0.78 ATM (0.55) KMT2AATML3MBTL1NAMPTPIK3CD
SCHEMBL17203603 0.75 ATM (0.77) KMT2AATML3MBTL1NAMPTPIK3CD
SCHEMBL14509638 0.75 ATM (0.77) KMT2AATML3MBTL1NAMPTPIK3CD
SCHEMBL5250912 0.73 ATM (0.75) KMT2AATML3MBTL1NAMPTDRD2
SCHEMBL6034582 0.72 ATM (0.97) KMT2AATML3MBTL1NAMPTPIK3CD
SCHEMBL10496019 0.72 ATM (0.76) KMT2AATML3MBTL1NAMPTPIK3CD
SCHEMBL26027930 0.71 POLB (0.51) KMT2AL3MBTL1TSHRMEN1KDM4E
SCHEMBL28239056 0.71 KMT2A (0.55) KMT2AATML3MBTL1NAMPTTSHR
SCHEMBL11609367 0.70 DRD2 (0.59) DRD2

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
CN-100519550-C 2-oxoindole compounds having inhibitory activity on glycogen synthase kinase 3 receptor ASTRAZENECA AB SE (SE) 2009-07-29 CN disclosed
CN-1923812-A New compounds ASTRAZENECA AB (SE) 2007-03-07 CN disclosed
CN-1642938-A Novel compounds ASTRAZENECA AB (SE) 2005-07-20 CN disclosed