SCHEMBL21724290

SCHEMBL21724290

O=S(=O)(O)OOS(=O)(=O)O.O=S(=O)([O-])OOS(=O)(=O)[O-].[Na+].[Na+]

nearest known ligand 0.62

Known targets — ChEMBL curated mechanism

ABCC8ACEADORA1ADORA2AADORA2BADORA3ALDH5A1ALOX5ALOX5APATP4AATP4BBRAFCA1CA12CA2CA4CYSLTR1DHFRDPEP1EDNRAEDNRBESR2F10FDPSFGF1GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTGNRHRGSC1HMGCRIMPDH1IMPDH2KCNJ11LY96NOD2NR3C1NS3NS4ANS5bP2RY1P2RY12P2RY2P2RY4P2RY6PBP2XPDE3APDE3BPDE4APDE4BPDE4CPDE4DPDK1PDK2PDK3PDK4PPARGPPATPTGIRPTGS1PTGS2RAF1RYR1RYR3SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASERPINC1SLC12A1SLC12A3SYKTHRATHRBTLR3TLR4TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYMSVKORC1XDHblablaIMP-1blaOXA-33blaOXA-58blaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAfolPfolP1ftsIfusAgaggyrAgyrBmecAmrcAmrcBmrdApbp1apbp1bpbp2pbp2apbp2bpbp3pbp4pbpApbpBpbpCpbpFpolponBrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpoArpoBrpoCrpoZrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CA2 known ✓ P00918 1/20 0.62
TSHR P16473 3/20 0.47
MEN1 O00255 1/20 0.47
ALDH1A1 P00352 1/20 0.47
KMT2A Q03164 1/20 0.47
TDP1 Q9NUW8 1/20 0.33
RECQL P46063 2/20 0.31
GLA P06280 1/20 0.31
HPGD P15428 1/20 0.31
MAPK1 P28482 1/20 0.31
EPHX2 P34913 1/20 0.31
BLM P54132 1/20 0.31

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
SCHEMBL658348 1.00 CA2 (0.62) CA2TSHRMEN1ALDH1A1KMT2A
SCHEMBL7757501 1.00 CA2 (0.62) CA2TSHRMEN1ALDH1A1KMT2A
SCHEMBL7758641 1.00 CA2 (0.62) CA2TSHRMEN1ALDH1A1KMT2A
SCHEMBL7758595 1.00 CA2 (0.62) CA2TSHRMEN1ALDH1A1KMT2A
SCHEMBL3863041 1.00 CA2 (0.62) CA2TSHRMEN1ALDH1A1KMT2A
SCHEMBL7757474 1.00 CA2 (0.62) CA2TSHRMEN1ALDH1A1KMT2A
SCHEMBL7753789 1.00 CA2 (0.62) CA2TSHRMEN1ALDH1A1KMT2A
SCHEMBL11318944 1.00 CA2 (0.62) CA2TSHRMEN1ALDH1A1KMT2A
SCHEMBL15271892 1.00 CA2 (0.62) CA2TSHRMEN1ALDH1A1KMT2A
SCHEMBL27636570 1.00 CA2 (0.62) CA2TSHRMEN1ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020036068-A1 DEGRADATION AGENT FOR VISCOUS FLUID AND METHOD FOR PRODUCING SAID DEGRADATION AGENT 三菱瓦斯化学株式会社 2020-02-20 WO disclosed
CN-109627369-A A kind of ordor removing lotion and preparation method thereof and ordor removing coating 广东银洋环保新材料有限公司 2019-04-16 CN disclosed
CN-109504190-A One kind is except methanal paint and preparation method thereof 广东银洋环保新材料有限公司 2019-03-22 CN disclosed
CN-108576049-A Sodium peroxydisulfate sterilizes degerming cleansing tablet and preparation method thereof 山西宝清化工有限公司 2018-09-28 CN disclosed
CN-104303340-A Negative electrode for secondary battery and method for producing same ZEON CORP 2015-01-21 CN disclosed
CN-102206394-B Water-containing copolymer dispersant and paint composition ROHM & HAAS 2014-02-12 CN disclosed
CN-102206394-A Water-containing copolymer dispersant and paint composition ROHM & HAAS 2011-10-05 CN disclosed
CN-1234913-C Process for producing sodium persulfate MITSUBISHI GAS CHEMICAL CO (JP) 2006-01-04 CN disclosed
CN-1315593-A Process for producing sodium persulfate MITSUBISHI GAS CHEMICAL CO (JP) 2001-10-03 CN disclosed