SCHEMBL8042782

SCHEMBL8042782

CS(=O)(=O)c1ccc2nc(Sc3nnnn3-c3nccs3)sc2c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 3/20 0.39
KMT2A Q03164 4/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
LMNA P02545 3/20 0.39
TP53 P04637 2/20 0.39
MAPT P10636 1/20 0.39
HTT P42858 1/20 0.39
MEN1 O00255 3/20 0.37
NPC1 O15118 3/20 0.37
RAB9A P51151 3/20 0.37
ALDH1A1 P00352 5/20 0.36
HPGD P15428 2/20 0.36
PIP4K2C Q8TBX8 1/20 0.36
CSNK1D P48730 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
ACP1 P24666 1/20 0.35
GAA P10253 1/20 0.35
KDM4E B2RXH2 1/20 0.35
RECQL P46063 1/20 0.35
GLO1 Q04760 1/20 0.35

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
SCHEMBL8048299 0.84 PKM (0.39) PKMKMT2ASMN1; SMN2LMNATP53
SCHEMBL8044412 0.83 SMN1; SMN2 (0.44) PKMKMT2ASMN1; SMN2LMNATP53
SCHEMBL8044167 0.83 PDK1 (0.51) PKMKMT2ASMN1; SMN2LMNAMAPT
SCHEMBL8052304 0.82 ALDH1A1 (0.49) PKMKMT2ASMN1; SMN2LMNATP53
SCHEMBL8042637 0.82 HPGD (0.41) PKMKMT2ASMN1; SMN2LMNATP53
SCHEMBL8047480 0.81 ALDH1A1 (0.39) PKMKMT2ASMN1; SMN2LMNATP53
SCHEMBL8048328 0.80 PKM (0.41) PKMKMT2ASMN1; SMN2LMNATP53
SCHEMBL8033160 0.80 PKM (0.51) PKMKMT2ASMN1; SMN2LMNATP53
SCHEMBL8044910 0.80 NPC1 (0.43) PKMKMT2ASMN1; SMN2LMNATP53
SCHEMBL8033856 0.80 PKM (0.46) PKMKMT2ASMN1; SMN2LMNATP53

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