SCHEMBL8041793

SCHEMBL8041793

O=C(O)Cc1csc(Sc2nnnn2-c2ccc(Br)cc2)n1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 4/20 0.43
KMT2A Q03164 6/20 0.41
MEN1 O00255 5/20 0.41
MAPK1 P28482 4/20 0.41
HSD17B10 Q99714 3/20 0.41
TSHR P16473 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41
TP53 P04637 2/20 0.41
ALDH1A1 P00352 7/20 0.40
LMNA P02545 4/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
MAPT P10636 3/20 0.40
PPARG P37231 1/20 0.40
HTT P42858 2/20 0.39
HPGD P15428 1/20 0.38
GAA P10253 1/20 0.38
BLM P54132 1/20 0.38
RECQL P46063 1/20 0.37
GABRA5 P31644 1/20 0.37

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
SCHEMBL8051833 0.90 POLB (0.54) POLBKMT2AMEN1MAPK1HSD17B10
SCHEMBL8034317 0.89 HPGD (0.51) POLBKMT2AMEN1MAPK1HSD17B10
SCHEMBL8047518 0.86 SMN1; SMN2 (0.53) POLBKMT2AMEN1MAPK1HSD17B10
SCHEMBL8044228 0.86 MAPT (0.41) POLBKMT2AMEN1MAPK1HSD17B10
SCHEMBL8051265 0.86 TP53 (0.41) POLBKMT2AMEN1MAPK1HSD17B10
SCHEMBL8050034 0.85 PTGS2 (0.43) POLBMAPK1HSD17B10TSHRNPSR1
SCHEMBL8042498 0.85 GAA (0.47) POLBKMT2AMEN1MAPK1HSD17B10
SCHEMBL8048121 0.83 ALDH1A1 (0.36) POLBKMT2AMEN1MAPK1HSD17B10
SCHEMBL8042328 0.82 HSD17B10 (0.48) POLBKMT2AMEN1MAPK1HSD17B10
SCHEMBL8033885 0.80 LIMK1 (0.45) POLBKMT2AMEN1TSHRNPSR1

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