SCHEMBL6181633

SCHEMBL6181633

O=S(=O)(Nc1nc(Cl)cnc1OCc1ccco1)c1cccs1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.53
KMT2A Q03164 3/20 0.53
MEN1 O00255 2/20 0.53
ALDH1A1 P00352 6/20 0.46
HSD17B10 Q99714 3/20 0.46
POLB P06746 2/20 0.46
RECQL P46063 1/20 0.46
ESR2 Q92731 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
CCR4 P51679 3/20 0.44
CCR2 P41597 2/20 0.43
KDM1A O60341 1/20 0.39
GAA P10253 1/20 0.39
TSHR P16473 1/20 0.39
FBP1 P09467 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MAPK1 P28482 1/20 0.38
USP2 O75604 1/20 0.37
MAPT P10636 1/20 0.37

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
SCHEMBL5103326 0.86 CCR4 (0.48) KDM4EKMT2AMEN1ALDH1A1CCR4
SCHEMBL4682218 0.84 KDM4E (0.69) KDM4EKMT2AMEN1ALDH1A1HSD17B10
SCHEMBL6182891 0.81 KDM4E (0.48) KDM4EKMT2AMEN1ALDH1A1HSD17B10
SCHEMBL6183896 0.80 CCR4 (0.64) KDM4EKMT2AMEN1ALDH1A1POLB
SCHEMBL6197275 0.79 CCR4 (0.44) KDM4EKMT2AMEN1ALDH1A1HSD17B10
SCHEMBL5103019 0.77 CCR4 (0.65) KDM4EKMT2AMEN1CCR4
SCHEMBL5617402 0.76 KDM4E (0.54) KDM4EKMT2AMEN1ALDH1A1HSD17B10
SCHEMBL6185693 0.76 CCR4 (0.37) KDM4EKMT2AMEN1ALDH1A1HSD17B10
SCHEMBL6182958 0.73 CCR4 (0.74) KDM4EKMT2AMEN1POLBCCR4
SCHEMBL5111658 0.71 CCR4 (0.68) KMT2AMEN1ALDH1A1CCR4SMN1; SMN2

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
EP-1458715-B1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2005-12-07 EP disclosed