SCHEMBL6906671

SCHEMBL6906671

O=C1c2cccc(S(=O)(=O)O)c2C(=O)c2c1cc(S(=O)(=O)O)c(O)c2O

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGAM1 P18669 7/20 0.74
PKLR P30613 9/20 0.55
PTPN1 P18031 2/20 0.55
BCL2 P10415 1/20 0.46
MCL1 Q07820 1/20 0.46
ALDH1A1 P00352 2/20 0.44
MAPT P10636 2/20 0.44
TSHR P16473 2/20 0.44
MAPK1 P28482 2/20 0.44
TDP1 Q9NUW8 2/20 0.44
LMNA P02545 1/20 0.44
HPGD P15428 1/20 0.44
ALOX15 P16050 1/20 0.44
MAOA P21397 1/20 0.44
MAOB P27338 1/20 0.44
HTT P42858 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
HSD17B10 Q99714 1/20 0.44
STAT3 P40763 1/20 0.44
NQO1 P15559 1/20 0.42

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
SCHEMBL5300737 0.89 PGAM1 (0.72) PGAM1PKLRPTPN1BCL2MCL1
Alizarin Red SCHEMBL29372853 0.85 PGAM1 (1.00) PGAM1PKLRPTPN1BCL2MCL1
Alizarin Red SCHEMBL29630358 0.85 PGAM1 (1.00) PGAM1PKLRPTPN1BCL2MCL1
Alizarin Red SCHEMBL1203855 0.85 PGAM1 (1.00) PGAM1PKLRPTPN1BCL2MCL1
SCHEMBL29561609 0.85 ALDH1A1 (0.54) PGAM1BCL2MCL1ALDH1A1MAPT
SCHEMBL2518286 0.85 ALDH1A1 (0.54) PGAM1BCL2MCL1ALDH1A1MAPT
SCHEMBL5308115 0.84 PGAM1 (0.74) PGAM1PKLRPTPN1BCL2MCL1
Alizarin Red SCHEMBL433811 0.84 PGAM1 (0.97) PGAM1PKLRPTPN1BCL2MCL1
Alizarin Red SCHEMBL728495 0.84 PGAM1 (0.97) PGAM1PKLRPTPN1BCL2MCL1
Alizarin Red SCHEMBL27607379 0.84 PGAM1 (0.97) PGAM1PKLRPTPN1BCL2MCL1

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-6815481-B2 FUSED DIBENZO THERMAL STABILIZERS SUCH AS ANTHRACENE, XANTHENE AND ANTHRONE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-11-09 US disclosed
US-20020032256-A1 Polybutadiene composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-03-14 US disclosed