SCHEMBL10617469

SCHEMBL10617469

O=S(=O)(O)OCCS(=O)(=O)c1ccc(N=Nc2ccccc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.57
CYP2D6 P10635 1/20 0.57
THRB P10828 1/20 0.44
MAPT P10636 5/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
HPGD P15428 1/20 0.41
TRPA1 O75762 1/20 0.40
MMP2 P08253 2/20 0.39
MMP7 P09237 1/20 0.39
MMP14 P50281 1/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CASP3 P42574 1/20 0.38
SENP8 Q96LD8 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
SENP6 Q9GZR1 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
HSD11B1 P28845 1/20 0.38

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
SCHEMBL1171141 0.85 HSD11B1 (0.50) POLBMAPTKMT2AMMP2MMP7
SCHEMBL12589933 0.84 THRB (0.41) POLBCYP2D6THRBMAPTMEN1
SCHEMBL14271158 0.84 THRB (0.41) POLBCYP2D6THRBMAPTMEN1
SCHEMBL19851316 0.82 THRB (0.40) POLBCYP2D6THRBMAPTMEN1
SCHEMBL13292118 0.81 THRB (0.38) POLBCYP2D6THRBMAPTMEN1
SCHEMBL12373370 0.81 THRB (0.38) POLBCYP2D6THRBMAPTMEN1
SCHEMBL19851320 0.81 THRB (0.39) POLBCYP2D6THRBMAPTMEN1
SCHEMBL19851319 0.80 THRB (0.39) POLBCYP2D6THRBMAPTMEN1
SCHEMBL27745045 0.79 THRB (0.37) POLBCYP2D6THRBMAPTMEN1
SCHEMBL15671887 0.79 THRB (0.48) POLBCYP2D6THRBMAPTMEN1

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
EP-0167219-B1 FIBER-REACTIVE COMPOUND HAVING BOTH PYRIDINIOTRIAZINYL AND VINYLSULFONE TYPE GROUPS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1988-09-28 EP disclosed
US-4626589-A Organic dye compound having both pyridiniotriazinyl and vinylsulfone type fiber-reactive groups SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1986-12-02 US disclosed