SCHEMBL4903342

SCHEMBL4903342

NC(=O)CC(C(=O)[O-])S(=O)(=O)O.NC(=O)CC(C(=O)[O-])S(=O)(=O)O.[Na+].[Na+]

nearest known ligand 0.36

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 10)

geneUniProtsupporting neighboursconfidence
CA4 known ✓ P22748 2/20 0.33
CA2 known ✓ P00918 1/20 0.30
CYP3A4 P08684 1/20 0.32
TSHR P16473 1/20 0.32
NFKB1 P19838 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
MEN1 O00255 1/20 0.31
LDHA P00338 1/20 0.31
BLM P54132 1/20 0.31
KMT2A Q03164 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
SCHEMBL726009 1.00 CA4 (0.33) CA4CYP3A4TSHRNFKB1NPSR1
SCHEMBL7115117 1.00 CA4 (0.33) CA4CYP3A4TSHRNFKB1NPSR1
Potassium Ion SCHEMBL17255813 0.96 MEN1 (0.31) CA4MEN1LDHABLMKMT2A
SCHEMBL170110 0.84
SCHEMBL7115121 0.83 CA4 (0.33) CA4MEN1LDHABLMKMT2A
SCHEMBL4903344 0.83 CA4 (0.33) CA4MEN1LDHABLMKMT2A
SCHEMBL187912 0.82 CA4 (0.46) CA4CYP3A4TSHRNFKB1NPSR1
SCHEMBL28810037 0.82
Ammonia Solution, Strong SCHEMBL21752715 0.82
Sulfuric Acid SCHEMBL29180311 0.82 BLM (0.32) BLM

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118746866-A Hydrophobic oleophobic antireflection film and preparation method thereof 江苏斯迪克新材料科技股份有限公司 2024-10-08 CN disclosed
CN-118048095-A Preparation process of solvent-free epoxy composite coating 江西百盛精细化学品有限公司 2024-05-17 CN disclosed
CN-114728254-A Polyurea microcapsules and liquid surfactant system containing the same 西姆莱斯股份公司 2022-07-08 CN disclosed
CN-114364773-A Aromatic oil mixture 西姆莱斯股份公司 2022-04-15 CN disclosed
CN-106893041-B Method for preparing solvent-free aqueous polyurethane dispersion 南亚塑胶工业股份有限公司 2022-04-12 CN disclosed
CN-114126579-A Mixture of beeswax and lactoyl lactate 西姆莱斯股份公司 2022-03-01 CN disclosed
CN-113993500-A Cool preparation 德国德之馨香精香料公司 2022-01-28 CN disclosed
CN-113891750-A Method for improving performance of spice or spice mixture 西姆莱斯股份公司 2022-01-04 CN disclosed
CN-113766911-A Plant peptides and uses thereof (II) 西姆莱斯股份公司 2021-12-07 CN disclosed
CN-113710331-A Antimicrobial mixture 西姆莱斯股份公司 2021-11-26 CN disclosed
CN-108473484-B Compounds useful as TRPM8 modulators 弗门尼舍公司 2021-06-29 CN disclosed
CN-112955230-A A method for resisting female body odor 西姆莱斯股份公司 2021-06-11 CN disclosed
CN-111971023-A Opaque composition comprising ethylene glycol distearate 赢创运营有限公司 2020-11-20 CN disclosed
US-20130340785-A1 KERATIN-BASED HAIR STRAIGHTENING FORMULATIONS, METHODS AND SYSTEMS BEAUTY BIOLABS LLC 2013-12-26 US disclosed
US-20080319118-A1 LABELED POLYMER DISPERSION AND ADHESIVES OBTAINED THEREFROM HENKEL AG & CO. KGAA (DE) 2008-12-25 US disclosed
US-7078448-B2 Mixture containing protective colloid, metal compound and phenol-formaldehyde resin; adhesive, surface coating HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2006-07-18 US disclosed
US-20060084739-A1 Labeled polymer dispersion and adhesives obtained therefrom HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (HENKEL KGAA) (DE) 2006-04-20 US disclosed
US-20050113499-A1 Low-emission aqueous dispersion adhesive ARIZONA CHEMICAL B.V. (NL) 2005-05-26 US disclosed
US-20040044138-A1 Mixture containing protective colloid, metal compound and phenol-formaldehyde resin; adhesive, surface coating HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (HENKEL KGAA) (DE) 2004-03-04 US disclosed
EP-0020125-A1 Polyolefins having addition polymer adherent thereto, their preparation and articles comprising them ROHM AND HAAS COMPANY (US) 1980-12-10 EP disclosed