SCHEMBL6155652

SCHEMBL6155652

O=S(=O)(O)c1ccccc1-c1ccccc1O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGAM1 P18669 1/20 0.44
ALDH1A1 P00352 3/20 0.43
HPGD P15428 3/20 0.43
HSD17B10 Q99714 3/20 0.43
BCL2L1 Q07817 1/20 0.43
STAT3 P40763 1/20 0.43
NFKB1 P19838 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
KDM4A O75164 1/20 0.41
USP2 O75604 1/20 0.41
NSD2 O96028 1/20 0.41
ALPL P05186 1/20 0.41
PLCG1 P19174 1/20 0.41
TNNI3 P19429 1/20 0.41
TNNT2 P45379 1/20 0.41
MMP14 P50281 1/20 0.41
CASP6 P55212 1/20 0.41
TNNC1 P63316 1/20 0.41
KDM4C Q9H3R0 1/20 0.41
PTPN1 P18031 1/20 0.41

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
SCHEMBL29700277 1.00 PGAM1 (0.44) PGAM1ALDH1A1HPGDHSD17B10BCL2L1
SCHEMBL458284 0.89 SMN1; SMN2 (0.48) PGAM1NFKB1L3MBTL1KDM4AUSP2
SCHEMBL28837581 0.86 SMN1; SMN2 (0.46) PGAM1NFKB1L3MBTL1KDM4AUSP2
SCHEMBL251787 0.86 STAT3 (0.43) PGAM1ALDH1A1HPGDHSD17B10BCL2L1
SCHEMBL4163086 0.86 NFKB1 (0.45) PGAM1ALDH1A1HPGDHSD17B10STAT3
SCHEMBL8516810 0.86 PGAM1 (0.45) PGAM1ALDH1A1HPGDHSD17B10BCL2L1
SCHEMBL27672974 0.84 ALDH1A1 (0.44) ALDH1A1HPGDHSD17B10BCL2L1STAT3
SCHEMBL251786 0.84 STAT3 (0.42) PGAM1ALDH1A1HPGDHSD17B10STAT3
SCHEMBL28882144 0.83 STAT3 (0.56) ALDH1A1HPGDHSD17B10BCL2L1STAT3
SCHEMBL460174 0.82 STAT3 (0.51) PGAM1ALDH1A1HPGDHSD17B10STAT3

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 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6303562-B1 ALKYLATING HYDROXYPHENYLBENZENESULFINIC/SULFONIC ACID COMPOUND WITH ALKENE OR SUBSTITUTED ALKENE TO FORM ALKYLATED PRODUCT ENCHIRA BIOTECHNOLOGY CORPORATION 2001-10-16 US claimed
WO-2000042005-A1 COMPOSITIONS COMPRISING 2-(2-HYDROXYPHENYL) BENZENESULFINATE AND ALKYL-SUBSTITUTED DERIVATIVES THEREOF ENERGY BIOSYSTEMS CORPORATION (US) 2000-07-20 WO claimed
CN-110683940-B Method for converting dibenzo [ c, e ] [1,2] oxathiane-6-oxide compound 中国科学院成都生物研究所 2022-07-01 CN disclosed
CN-110683940-A Method for converting dibenzo [ c, e ] [1,2] oxathiane-6-oxide compound 中国科学院成都生物研究所 2020-01-14 CN disclosed
EP-0917563-B1 MICRO-ORGANISM WHICH CAN DESULPHURISE BENZOTHIOPHENES UNIV NAPIER (GB) 2005-02-02 EP disclosed
EP-0651808-B1 RECOMBINANT DNA ENCODING A DESULFURIZATION BIOCATALYST ENERGY BIOSYSTEMS CORP (US) 2001-12-12 EP disclosed
US-6303562-B1 ALKYLATING HYDROXYPHENYLBENZENESULFINIC/SULFONIC ACID COMPOUND WITH ALKENE OR SUBSTITUTED ALKENE TO FORM ALKYLATED PRODUCT ENCHIRA BIOTECHNOLOGY CORPORATION 2001-10-16 US disclosed
US-6303562-B1 ALKYLATING HYDROXYPHENYLBENZENESULFINIC/SULFONIC ACID COMPOUND WITH ALKENE OR SUBSTITUTED ALKENE TO FORM ALKYLATED PRODUCT ENCHIRA BIOTECHNOLOGY CORPORATION 2001-10-16 US disclosed
US-20010008770-A1 MICRO-ORGANISM WHICH CAN DESULPHURISE BENZOTHIOPHENES OLDFIELD CHRISTOPHER (GB) 2001-07-19 US disclosed
WO-2000042005-A1 COMPOSITIONS COMPRISING 2-(2-HYDROXYPHENYL) BENZENESULFINATE AND ALKYL-SUBSTITUTED DERIVATIVES THEREOF ENERGY BIOSYSTEMS CORPORATION (US) 2000-07-20 WO disclosed
WO-2000042005-A1 COMPOSITIONS COMPRISING 2-(2-HYDROXYPHENYL) BENZENESULFINATE AND ALKYL-SUBSTITUTED DERIVATIVES THEREOF ENERGY BIOSYSTEMS CORPORATION (US) 2000-07-20 WO disclosed
US-5973195-A Surfactants derived from 2-(2-hydroxyphenyl)benzenesulfinate and alkyl-substituted derivatives ENERGY BIOSYSTEMS CORPORATION (US) 1999-10-26 US disclosed
US-5968812-A Removal of sulfinic acids ENERGY BIOSYSTEMS CORPORATION (US) 1999-10-19 US disclosed
WO-1999047496-A1 SURFACTANTS DERIVED FROM 2-(2-HYDROXYPHENYL) BENZENESULFINATE ENERGY BIOSYSTEMS CORPORATION (US) 1999-09-23 WO disclosed
US-5879914-A DESULFURIZING FOSSIL FUELS USING TRANSFORMED MICROORGANISM CONTAINING RECOMBINANT DNA FROM RHODOCOCCUS WHICH EXPRESSES BIOCATALYST ENERGY BIOSYSTEMS CORPORATION (US) 1999-03-09 US disclosed
US-5578478-A Recombinant DNA encoding a desulfurization biocatalyst ENERGY BIOSYSTEMS CORPORATION (US) 1996-11-26 US disclosed
US-5356801-A From Rhodococcus rhodochrous ENERGY BIOSYSTEMS CORPORATION (US) 1994-10-18 US disclosed
US-4042618-A FIBER AND FILM FORMING POLYMERS CELANESE CORPORATION (US) 1977-08-16 US disclosed