SCHEMBL8043583

SCHEMBL8043583

CS(=O)(=O)c1cnc(Sc2nnc(CC(=O)O)s2)s1

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 1/20 0.33
IRS1 P35568 1/20 0.33
GAB1 Q13480 1/20 0.33
MAPK8 P45983 4/20 0.32
MAPK9 P45984 4/20 0.32
FFAR2 O15552 1/20 0.32
LOXL2 Q9Y4K0 3/20 0.31
MAPK10 P53779 1/20 0.31
LOX P28300 1/20 0.31
GSK3B P49841 1/20 0.30
GAA P10253 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL8043647 0.89 F2 (0.40) MAPK8MAPK9FFAR2LOXL2MAPK10
SCHEMBL8043608 0.88 APEX1 (0.33) MAPK8MAPK9FFAR2
SCHEMBL8042354 0.85 MAPK8 (0.34) MAPK8MAPK9FFAR2LOXL2MAPK10
SCHEMBL8042764 0.84 SMN1; SMN2 (0.42) AKT1IRS1GAB1GAA
SCHEMBL8043817 0.84 MAPK8 (0.37) AKT1MAPK8MAPK9LOXL2MAPK10
SCHEMBL8044752 0.83 MAPK8 (0.33) MAPK8MAPK9FFAR2LOXL2MAPK10
SCHEMBL8048119 0.82 MAPK8 (0.38) MAPK8MAPK9LOXL2MAPK10LOX
SCHEMBL8041884 0.81 MAPK8 (0.36) MAPK8MAPK9LOXL2MAPK10LOX
SCHEMBL8044039 0.81 ALDH1A1 (0.37) MAPK8MAPK9LOXL2MAPK10LOX
SCHEMBL8044491 0.80 LMNA (0.48) LOXL2

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