SCHEMBL7535345

SCHEMBL7535345

CCCCn1c(S(C)(=O)=O)c(CC)c(=O)[nH]c1=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.49
ATM Q13315 2/20 0.47
MAPT P10636 1/20 0.47
KDM4E B2RXH2 5/20 0.43
GAA P10253 4/20 0.43
ALDH1A1 P00352 4/20 0.43
LMNA P02545 2/20 0.43
PDE4A P27815 2/20 0.43
ADORA2A P29274 2/20 0.43
PDE4B Q07343 2/20 0.43
PDE4C Q08493 2/20 0.43
PDE4D Q08499 2/20 0.43
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
BRD4 O60885 1/20 0.41
BRD2 P25440 1/20 0.41
BRD3 Q15059 1/20 0.41
BRDT Q58F21 1/20 0.41
TSHR P16473 2/20 0.39
TP53 P04637 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
SCHEMBL7536900 0.79 MAPT (0.44) SMN1; SMN2ATMMAPTKDM4EGAA
SCHEMBL7536902 0.74 SMN1; SMN2 (0.50) SMN1; SMN2ATMMAPTKDM4EGAA
SCHEMBL11122898 0.68 MAPT (0.69) ATMMAPTKDM4EGAAALDH1A1
SCHEMBL8426912 0.67 ALDH1A1 (0.46) SMN1; SMN2ATMMAPTKDM4EGAA
SCHEMBL7213295 0.67 ALDH1A1 (0.50) SMN1; SMN2ATMMAPTKDM4EGAA
SCHEMBL11637084 0.67 MAPT (0.53) ATMMAPTKDM4EGAAALDH1A1
SCHEMBL2784423 0.67 ATM (0.53) ATMMAPTKDM4EGAAALDH1A1
SCHEMBL8426881 0.66 MAPT (0.43) SMN1; SMN2ATMMAPTKDM4EGAA
SCHEMBL1945482 0.66 MAPT (0.71) SMN1; SMN2ATMMAPTKDM4EGAA
SCHEMBL11709001 0.65 ATM (0.51) ATMMAPTKDM4EGAAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0748316-B1 PYRIMIDINE ACYCLONUCLEOSIDE DERIVATIVES SUNKYONG IND LTD (KR) 2002-05-08 EP disclosed
US-5889013-A REACTING AN URACIL COMPOUND WITH N, O-BIS/TRIMETHYLSILYL/ACETAMIDE FOLLOWED BY TETRABUTYLAMMONIUM IODIDE AND CHLOROMETHYL ETHER COMPOUND AND THEN REACTING WITH ARYL SELENOL IN A BASE SUNKYONG INDUSTRIES CO., INC. (KR) 1999-03-30 US disclosed
EP-0748316-A1 PYRIMIDINE ACYCLONUCLEOSIDE DERIVATIVES SUNKYONG INDUSTRIES CO., LTD. (KR) 1996-12-18 EP disclosed
WO-1995023138-A1 PYRIMIDINE ACYCLONUCLEOSIDE DERIVATIVES SUNKYONG INDUSTRIES CO., LTD. (KR) 1995-08-31 WO disclosed