SCHEMBL3083351

SCHEMBL3083351

O=S(=O)([O-])c1ccc(/N=N/c2ccc(O)c3ccccc23)cc1.[Na+]

nearest known ligand 0.65

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 20)

geneUniProtsupporting neighboursconfidence
▸ THRB known ✓ P10828 2/20 0.55
▸ MEN1 O00255 3/20 0.65
▸ KMT2A Q03164 3/20 0.65
▸ MAPT P10636 3/20 0.65
▸ TDP1 Q9NUW8 2/20 0.65
▸ POLB P06746 1/20 0.65
▸ MAPK1 P28482 1/20 0.65
▸ LMNA P02545 1/20 0.64
▸ GAA P10253 1/20 0.64
▸ HPGD P15428 1/20 0.64
▸ NPSR1 Q6W5P4 1/20 0.64
▸ L3MBTL1 Q9Y468 1/20 0.64
▸ GLO1 Q04760 3/20 0.59
▸ PTPN1 P18031 1/20 0.57
▸ DUSP5 Q16690 1/20 0.57
▸ ATIC P31939 1/20 0.53
▸ PLCG1 P19174 1/20 0.52
▸ NPC1 O15118 2/20 0.52
▸ RAB9A P51151 2/20 0.52
▸ ATM Q13315 2/20 0.52

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
SCHEMBL9645286 1.00 MEN1 (0.65) MEN1KMT2AMAPTTDP1POLB
SCHEMBL29352135 1.00 MEN1 (0.65) MEN1KMT2AMAPTTDP1POLB
SCHEMBL29933125 0.87 ATIC (0.69) MEN1KMT2AMAPTTDP1POLB
SCHEMBL31658970 0.87 ATIC (0.69) MEN1KMT2AMAPTTDP1POLB
SCHEMBL2203513 0.87 ATIC (0.69) MEN1KMT2AMAPTTDP1POLB
SCHEMBL2203510 0.87 ATIC (0.69) MEN1KMT2AMAPTTDP1POLB
SCHEMBL11511844 0.85 LMNA (0.64) MEN1KMT2AMAPTTDP1POLB
SCHEMBL11411897 0.85 ATIC (0.67) MEN1KMT2AMAPTTDP1POLB
SCHEMBL11511843 0.85 LMNA (0.64) MEN1KMT2AMAPTTDP1POLB
SCHEMBL1309169 0.84 L3MBTL1 (0.63) MEN1KMT2AMAPTTDP1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1973974-B1 A PROCESS FOR PREPARING 'ONIUM SALTS SUN CHEMICAL CORP (US) 2014-04-30 — — EP claimed
EP-1973974-A2 A PROCESS FOR PREPARING 'ONIUM SALTS Sun Chemical Corporation (US) 2008-10-01 — — EP claimed
WO-2007075498-A2 A PROCESS FOR PREPARING 'ONIUM SALTS SUN CHEMICAL CORPORATION (US) 2007-07-05 — — WO claimed
US-5143023-A Animal litter with chemically bound chemical indicators KLEANHEART, INC. (US) 1992-09-01 — — US claimed
US-20250108658-A1 INKJET PRINTING PROCESSES FOR TEMPORARY TATTOOS Prism Inks, Inc. (US) 2025-04-03 — — US disclosed
EP-3597670-B1 WATER-SOLUBLE COMPOSITION, PRODUCTION METHOD FOR CURED PRODUCT THEREOF, AND CURED PRODUCT THEREOF, AND ACYL PHOSPHINATE ADEKA CORP (JP) 2024-07-10 — — EP disclosed
US-11649334-B2 Water-soluble composition, production method for cured product thereof, and cured product thereof, and acyl phosphinate ADEKA CORPORATION (JP) 2023-05-16 — — US disclosed
WO-2022188373-A1 METHOD FOR DETECTING WATER-SOLUBLE ANIONIC SYNTHETIC PIGMENT IN FOOD 广州市食品检验所(广州市酒类检测中心) 2022-09-15 — — WO disclosed
CN-113638248-A Dyeing slurry with high tinting strength and preparation method thereof 上海艾纺纺织品有限公司 2021-11-12 — — CN disclosed
US-20200123371-A1 WATER-SOLUBLE COMPOSITION AND CURED PRODUCT THEREOF ADEKA CORPORATION (JP) 2020-04-23 — — US disclosed
US-20200032021-A1 WATER-SOLUBLE COMPOSITION, PRODUCTION METHOD FOR CURED PRODUCT THEREOF, AND CURED PRODUCT THEREOF, AND ACYL PHOSPHINATE ADEKA CORPORATION (JP) 2020-01-30 — — US disclosed
EP-3470463-A1 WATER-SOLUBLE COMPOSITION AND CURED PRODUCT THEREOF Adeka Corporation (JP) 2019-04-17 — — EP disclosed
US-20120141398-A1 HAIR DYE CONTAINING ONE OR MORE EDIBLE OR COSMETIC COLORS CHUANG KUO SHENG (TW) 2012-06-07 — — US disclosed
US-7863459-B2 Process for preparing onium salts SUN CHEMICAL CORPORATION (US) 2011-01-04 — — US disclosed
US-20100224508-A1 Ink composition for sensing carbon dioxide gas, carbon dioxide indicator using the same, package provided with the carbon dioxide indicator, and method for sensing pinhole using the same TOPPAN PRINTING CO., LTD. (JP) 2010-09-09 — — US disclosed
US-20080287686-A1 Process for Preparing Onium Salts SUN CHEMICAL CORP (US) 2008-11-20 — — US disclosed
EP-1400574-A1 Colour changing paint Akzo Nobel Decorative Coatings Ltd. (GB) 2004-03-24 — — EP disclosed
US-5143023-A Animal litter with chemically bound chemical indicators KLEANHEART, INC. (US) 1992-09-01 — — US disclosed
US-4188320-A Ester of higher fatty acid and reagent for determination of activity of lipase CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 1980-02-12 — — US disclosed
US-4105839-A Method for polymerizing ethylenically unsaturated monomers in order to eliminate polymer deposition SHIN-ETSU CHEMICAL CO., LTD. (JP) 1978-08-08 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20200032021-A1 WATER-SOLUBLE COMPOSITION, PRODUCTION METHOD FOR CURED PRODUCT THEREOF, AND CURED PRODUCT THEREOF, AND ACYL PHOSPHINATE PHOSPHO1, ASS1, SGMS1 THRB 4166/4885MEN1 551/4885KMT2A 604/4885
US-20080287686-A1 Process for Preparing Onium Salts IK, NOTUM, NOS2 THRB 4400/4885MEN1 3526/4885KMT2A 2078/4885
US-11649334-B2 Water-soluble composition, production method for cured product thereof, and cured product thereof, and acyl phosphinate PHOSPHO1, ASS1, SGMS1 THRB 4166/4885MEN1 551/4885KMT2A 604/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

Send feedback