SCHEMBL14178232

SCHEMBL14178232

CC(=O)CC(=O)NS(C)(=O)=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.38
CA1 P00915 1/20 0.38
CA4 P22748 1/20 0.38
CA7 P43166 1/20 0.38
MGAM O43451 1/20 0.38
GAA P10253 1/20 0.38
SI P14410 1/20 0.38
MGAM2 Q2M2H8 1/20 0.38
HTT P42858 2/20 0.35
LMNA P02545 1/20 0.35
EPHX2 P34913 2/20 0.34
CXCL8 P10145 1/20 0.34
ALDH1A1 P00352 2/20 0.33
MAPT P10636 2/20 0.33
TDP1 Q9NUW8 1/20 0.33
KDM4E B2RXH2 1/20 0.33
KDM6B O15054 1/20 0.33
KDM5C P41229 1/20 0.33
EGLN1 Q9GZT9 1/20 0.33
PHF8 Q9UPP1 1/20 0.33

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
SCHEMBL6846135 0.81
Hydrochloric Acid SCHEMBL31301878 0.79 CA2 (0.40) CA2CA1LMNAEPHX2CXCL8
SCHEMBL9638392 0.78 CA1 (0.38) CA2CA1CA4CA7MGAM
SCHEMBL18778812 0.78 LDHA (0.42) CA2EPHX2CXCL8KDM4EKDM5C
SCHEMBL3713808 0.78
SCHEMBL28205206 0.78 FNTA (0.47) CA2CA1CA4CA7MGAM
SCHEMBL3182370 0.78 FNTA (0.47) CA2CA1CA4CA7MGAM
SCHEMBL92834 0.78
SCHEMBL1385036 0.76
Fluoride SCHEMBL10492292 0.76 FNTA (0.46) CA2CA1CA4CA7MGAM

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
US-7371852-B2 Alkyl-linked nucleotide compositions SERENEX, INC. (US) 2008-05-13 US disclosed