SCHEMBL8043647

SCHEMBL8043647

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

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
F2 P00734 1/20 0.40
LOXL2 Q9Y4K0 6/20 0.33
MAPK8 P45983 3/20 0.33
MAPK9 P45984 3/20 0.33
MAPK10 P53779 1/20 0.33
LOX P28300 1/20 0.33
FFAR2 O15552 1/20 0.31
ALDH1A1 P00352 1/20 0.30
RAB9A P51151 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
SCHEMBL8043583 0.89 AKT1 (0.33) LOXL2MAPK8MAPK9MAPK10LOX
SCHEMBL8042354 0.84 MAPK8 (0.34) LOXL2MAPK8MAPK9MAPK10LOX
SCHEMBL8042764 0.83 SMN1; SMN2 (0.42) ALDH1A1RAB9A
SCHEMBL8043817 0.83 MAPK8 (0.37) LOXL2MAPK8MAPK9MAPK10LOX
SCHEMBL8044752 0.82 MAPK8 (0.33) LOXL2MAPK8MAPK9MAPK10LOX
SCHEMBL8043608 0.81 APEX1 (0.33) MAPK8MAPK9FFAR2ALDH1A1
SCHEMBL8048119 0.81 MAPK8 (0.38) LOXL2MAPK8MAPK9MAPK10LOX
SCHEMBL8044039 0.80 ALDH1A1 (0.37) LOXL2MAPK8MAPK9MAPK10LOX
SCHEMBL8041884 0.80 MAPK8 (0.36) LOXL2MAPK8MAPK9MAPK10LOX
SCHEMBL8034054 0.79 F2 (0.44) F2MAPK8MAPK9MAPK10ALDH1A1

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