SCHEMBL28097557

SCHEMBL28097557

CCCCCCOS(=O)(=O)O.CCc1nccn1C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 9/20 0.37
CA2 P00918 9/20 0.37
CA9 Q16790 8/20 0.37
CA12 O43570 3/20 0.37
CA7 P43166 3/20 0.37
CA14 Q9ULX7 3/20 0.37
CA3 P07451 2/20 0.37
CA4 P22748 2/20 0.37
CA6 P23280 2/20 0.37
CA5A P35218 2/20 0.37
CA5B Q9Y2D0 2/20 0.37
RECQL P46063 2/20 0.36
MAPK1 P28482 2/20 0.36
GLA P06280 1/20 0.36
HPGD P15428 1/20 0.36
TSHR P16473 1/20 0.36
EPHX2 P34913 1/20 0.36
S1PR3 Q99500 1/20 0.36
BLM P54132 1/20 0.36
TLR8 Q9NR97 2/20 0.36

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
SCHEMBL38662529 0.85 ALDH1A1 (0.42) CA1CA2CA9CA12CA7
SCHEMBL9929077 0.83 FDPS (0.41) CA1CA2CA9CA12CA7
SCHEMBL27774281 0.81 L3MBTL1 (0.39) CA1CA2CA9CA12CA7
SCHEMBL28031165 0.81 L3MBTL1 (0.39) CA1CA2CA9CA12CA7
SCHEMBL28604121 0.81 KMT2A (0.37) CA1CA2HPGDTSHRFDPS
SCHEMBL28076144 0.80 FDPS (0.43) CA1CA2CA9CA12CA7
SCHEMBL28204463 0.80 FDPS (0.43) CA1CA2CA9CA12CA7
Sulfuric Acid SCHEMBL28845974 0.80 FDPS (0.47) CA1CA2CA9CA12CA7
Sulfuric Acid SCHEMBL2857065 0.80 FDPS (0.47) CA1CA2CA9CA12CA7
Sulfuric Acid SCHEMBL28074354 0.80 FDPS (0.47) CA1CA2CA9CA12CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104947411-B Multifunctional fabric slip compositions and preparation method thereof 安徽理工大学 2016-09-28 CN claimed
CN-108677522-A A kind of uvioresistant, flame-retardant multifunctional coated fabric finishing agent and finishing technique 盐城工学院 2018-10-19 CN disclosed