SCHEMBL8043593

SCHEMBL8043593

Cc1nnc(Sc2ncc(S(C)(=O)=O)s2)s1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ICAM1 P05362 2/20 0.37
SELE P16581 2/20 0.37
VCAM1 P19320 2/20 0.37
GAA P10253 4/20 0.36
MAPK8 P45983 3/20 0.35
MAPK9 P45984 3/20 0.35
MAPK10 P53779 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
MAPT P10636 2/20 0.35
KDR P35968 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
PKM P14618 1/20 0.34
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
ALDH1A1 P00352 2/20 0.33
LMNA P02545 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
SCHEMBL8051724 0.83 MAPK8 (0.54) ICAM1SELEVCAM1GAAMAPK8
SCHEMBL8050241 0.81 CA1 (0.35) MAPK8MAPK9MAPK10MAPTMEN1
SCHEMBL8043817 0.81 MAPK8 (0.37) MAPK8MAPK9MAPK10MAPTMEN1
SCHEMBL8043833 0.81 MAPK8 (0.34) MAPK8MAPK9MAPK10NPC1RAB9A
SCHEMBL8042354 0.80 MAPK8 (0.34) MAPK8MAPK9MAPK10
SCHEMBL8048119 0.79 MAPK8 (0.38) GAAMAPK8MAPK9MAPK10KMT2A
SCHEMBL8044039 0.77 ALDH1A1 (0.37) GAAMAPK8MAPK9MAPK10MEN1
SCHEMBL8044752 0.77 MAPK8 (0.33) MAPK8MAPK9MAPK10
SCHEMBL8041884 0.77 MAPK8 (0.36) MAPK8MAPK9MAPK10NPC1RAB9A
SCHEMBL8043583 0.76 AKT1 (0.33) GAAMAPK8MAPK9MAPK10L3MBTL1

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-6080772-A 2-AMINOTHIAZOLE TRIAZOLE OR TETRAZOLE COMPOUND FOR REGULATING PROTEIN TYROSINE PHOSPHATASE ACTIVITY SUGEN, INC. (US) 2000-06-27 US disclosed