SCHEMBL27280780

SCHEMBL27280780

C#CCOC(=O)CCC(=O)O.CC(Br)S(=O)(=O)O

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.39
ALDH1A1 P00352 1/20 0.37
TAAR1 Q96RJ0 1/20 0.37
TSHR P16473 2/20 0.37
GSTP1 P09211 1/20 0.36
KDM6B O15054 1/20 0.33
KDM5C P41229 1/20 0.33
EGLN1 Q9GZT9 1/20 0.33
PHF8 Q9UPP1 1/20 0.33
KDM2A Q9Y2K7 1/20 0.33
EPHX2 P34913 1/20 0.32
LMNA P02545 1/20 0.31
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31
CA14 Q9ULX7 1/20 0.31

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
SCHEMBL8430617 0.82 TSHR (0.50) L3MBTL1ALDH1A1TAAR1TSHRGSTP1
SCHEMBL27276459 0.81 L3MBTL1 (0.39) L3MBTL1ALDH1A1TAAR1TSHRGSTP1
SCHEMBL17695709 0.77 TSHR (0.46) L3MBTL1ALDH1A1TAAR1TSHRGSTP1
SCHEMBL27279873 0.77 TSHR (0.46) L3MBTL1ALDH1A1TAAR1TSHRGSTP1
SCHEMBL27281476 0.75 TSHR (0.44) L3MBTL1ALDH1A1TAAR1TSHRGSTP1
SCHEMBL4446043 0.74 GSTP1 (0.53) L3MBTL1ALDH1A1TAAR1TSHRGSTP1
SCHEMBL10012842 0.72 LMNA (0.44) L3MBTL1ALDH1A1TAAR1TSHRGSTP1
SCHEMBL10476502 0.72 GSTP1 (0.42) L3MBTL1ALDH1A1TAAR1TSHRGSTP1
SCHEMBL27280779 0.71 GSTP1 (0.40) L3MBTL1ALDH1A1TAAR1TSHRGSTP1
SCHEMBL1483317 0.71 GSTP1 (0.57) L3MBTL1ALDH1A1TAAR1TSHRGSTP1

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-1016000-B SIZING AGENT CHIYODA KENKYUSHO K K (JP) 1992-03-25 CN disclosed
CN-87104680-A SIZING AGENT 1988-12-14 CN disclosed