SCHEMBL8043594

SCHEMBL8043594

NS(=O)(=O)c1ccc(-n2c(Sc3nc4c(Cl)cccc4s3)nnc2-c2cccs2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.43
HSD17B10 Q99714 4/20 0.42
KDM4E B2RXH2 3/20 0.42
NPSR1 Q6W5P4 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
PTGS2 P35354 4/20 0.41
PTGS1 P23219 1/20 0.41
ALDH1A1 P00352 2/20 0.38
MAPK1 P28482 1/20 0.38
HSP90AA1 P07900 1/20 0.38
HSP90AB1 P08238 1/20 0.38
CA2 P00918 7/20 0.37
CA1 P00915 6/20 0.37
CA9 Q16790 6/20 0.37
CA4 P22748 3/20 0.37
CA12 O43570 2/20 0.37
RECQL P46063 1/20 0.36
GAA P10253 1/20 0.36
MEN1 O00255 1/20 0.35
PPARG P37231 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
SCHEMBL8044158 0.87 TSHR (0.54) TSHRHSD17B10KDM4ENPSR1SMN1; SMN2
SCHEMBL8042778 0.86 TSHR (0.43) TSHRHSD17B10KDM4ENPSR1SMN1; SMN2
SCHEMBL8043830 0.85 TSHR (0.45) TSHRHSD17B10KDM4ENPSR1SMN1; SMN2
SCHEMBL8042008 0.85 HSD17B10 (0.49) TSHRHSD17B10KDM4ENPSR1SMN1; SMN2
SCHEMBL8042040 0.84 TSHR (0.43) TSHRHSD17B10KDM4ENPSR1SMN1; SMN2
SCHEMBL8041896 0.84 TSHR (0.43) TSHRHSD17B10KDM4ENPSR1SMN1; SMN2
SCHEMBL8047465 0.84 NPSR1 (0.47) TSHRHSD17B10KDM4ENPSR1SMN1; SMN2
SCHEMBL8048191 0.83 TSHR (0.45) TSHRHSD17B10KDM4ENPSR1SMN1; SMN2
SCHEMBL8048668 0.81 TSHR (0.49) TSHRHSD17B10KDM4ENPSR1SMN1; SMN2
SCHEMBL8033666 0.81 PTGS2 (0.45) TSHRHSD17B10KDM4ENPSR1SMN1; SMN2

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