SCHEMBL8046237

SCHEMBL8046237

CS(=O)(=O)c1ccc2nc(Sc3nnc(N)s3)sc2c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 2/20 0.52
ALDH1A1 P00352 4/20 0.48
KMT2A Q03164 3/20 0.48
LMNA P02545 3/20 0.48
HPGD P15428 3/20 0.48
KDM4E B2RXH2 1/20 0.48
HSD17B10 Q99714 1/20 0.48
MAPT P10636 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
HTT P42858 2/20 0.47
TP53 P04637 1/20 0.47
ILK Q13418 1/20 0.47
MEN1 O00255 1/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
PIK3CD O00329 2/20 0.44
PIK3CB P42338 2/20 0.44
PI4KA P42356 2/20 0.44
PIK3CG P48736 2/20 0.44
PI4KB Q9UBF8 2/20 0.44

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
SCHEMBL8044884 0.86 PKM (0.50) PKMALDH1A1KMT2ALMNAHPGD
SCHEMBL8051553 0.83 ALDH1A1 (0.47) PKMALDH1A1KMT2ALMNAHPGD
SCHEMBL8046298 0.83 PKM (0.47) PKMALDH1A1KMT2ALMNAHPGD
SCHEMBL8051362 0.83 PKM (0.47) PKMALDH1A1KMT2ALMNAHPGD
SCHEMBL8049853 0.82 PKM (0.46) PKMALDH1A1KMT2ALMNAHPGD
SCHEMBL8042318 0.82 PKM (0.46) PKMALDH1A1KMT2ALMNAHPGD
SCHEMBL8046571 0.81 PKM (0.45) PKMALDH1A1KMT2ALMNAHPGD
SCHEMBL8033021 0.81 KMT2A (0.49) PKMALDH1A1KMT2ALMNAHPGD
SCHEMBL8043158 0.81 PKM (0.46) PKMALDH1A1KMT2ALMNAKDM4E
SCHEMBL8044136 0.80 PKM (0.44) PKMALDH1A1KMT2ALMNAHPGD

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
US-6080772-A 2-AMINOTHIAZOLE TRIAZOLE OR TETRAZOLE COMPOUND FOR REGULATING PROTEIN TYROSINE PHOSPHATASE ACTIVITY SUGEN, INC. (US) 2000-06-27 US disclosed
WO-1998027092-A1 THIAZOLE COMPOUNDS AND METHODS OF MODULATING SIGNAL TRANSDUCTION SUGEN, INC. (US) 1998-06-25 WO disclosed