SCHEMBL1786498

SCHEMBL1786498

O=S(=O)([O-])c1cccc2cccc(Nc3ccccc3)c12.[Na+]

nearest known ligand 0.70

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
P2RY12 known ✓ Q9H244 5/20 0.46
P2RY2 known ✓ P41231 4/20 0.46
P2RY4 known ✓ P51582 3/20 0.46
P2RY6 known ✓ Q15077 3/20 0.46
P2RY1 known ✓ P47900 2/20 0.46
CDK2 P24941 3/20 0.70
TTR P02766 1/20 0.70
FABP4 P15090 1/20 0.70
CCNA2 P20248 1/20 0.70
MAPK14 Q16539 1/20 0.70
NR4A1 P22736 1/20 0.68
FABP1 P07148 1/20 0.54
CHAT P28329 1/20 0.47
SNCA P37840 1/20 0.47
ALDH1A1 P00352 2/20 0.46
TP53 P04637 1/20 0.46
CYP3A4 P08684 1/20 0.46
HPGD P15428 1/20 0.46
ALOX15 P16050 1/20 0.46
TSHR P16473 1/20 0.46

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
SCHEMBL30804385 1.00 CDK2 (0.70) CDK2TTRFABP4CCNA2MAPK14
SCHEMBL6654762 0.97 CDK2 (0.70) CDK2TTRFABP4CCNA2MAPK14
SCHEMBL30088900 0.97 CDK2 (0.70) CDK2TTRFABP4CCNA2MAPK14
SCHEMBL29837420 0.90 CDK2 (0.84) CDK2TTRFABP4CCNA2MAPK14
SCHEMBL1357870 0.90 CDK2 (0.62) CDK2TTRFABP4CCNA2MAPK14
SCHEMBL11215465 0.83 FABP4 (0.72) CDK2TTRFABP4CCNA2MAPK14
SCHEMBL43158 0.83 FABP4 (1.00) CDK2TTRFABP4CCNA2MAPK14
SCHEMBL29381891 0.83 FABP4 (1.00) CDK2TTRFABP4CCNA2MAPK14
SCHEMBL10353163 0.81 FABP4 (0.97) CDK2TTRFABP4CCNA2MAPK14
SCHEMBL6654772 0.81 FABP4 (0.97) CDK2TTRFABP4CCNA2MAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230358677-A1 Reversible Excited-State Photoacids and Photobases as Dynamic Fluorescence Sensors of Protonic Species CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2023-11-09 US claimed
US-20260085262-A1 ACQ FLUORESCENCE PROBE COMPOSITION, CMC DETERMINATION METHOD, STAIN CLEANING CONCENTRATION DETERMINATION METHOD, DETERGENT DISPENSING CONTROL METHOD, AND DETERGENT DISPENSING CONTROL SYSTEM GUANGZHOU BLUEMOON IND CO LTD (CN) 2026-03-26 US disclosed
EP-4628560-A1 ACQ FLUORESCENT PROBE COMPOSITION, CMC DETERMINATION METHOD, STAIN REMOVAL CONCENTRATION DETERMINATION METHOD, AND DETERGENT DISPENSING CONTROL METHOD AND SYSTEM GUANGZHOU BLUEMOON INDUSTRIAL CO., LTD. (CN) 2025-10-08 EP disclosed
CN-118930607-B Self-assembled antibacterial peptide for resisting drug-resistant bacteria, and preparation method and application thereof 东北农业大学 2025-06-10 CN disclosed
US-20250067734-A1 Fluorescent Cellulose Particles ASAHI KASEI KABUSHIKI KAISHA (JP) 2025-02-27 US disclosed
CN-119522260-A ACQ fluorescent probe composition, cmc measurement method, stain cleaning concentration determination method, detergent addition control method and system 广州蓝月亮实业有限公司 2025-02-25 CN disclosed
CN-118930607-A Self-assembled antibacterial peptide for resisting drug-resistant bacteria, and preparation method and application thereof 东北农业大学 2024-11-12 CN disclosed
CN-118766078-A Method for preparing idesia oil Pickering emulsion 贵阳学院 2024-10-15 CN disclosed
CN-118716608-A Preparation method and application of quercetin-loaded modified protein-polysaccharide compound gel 扬州大学 2024-10-01 CN disclosed
CN-118511991-A Preparation and application of Rosa roxburghii polyphenol-sodium alginate-soybean protein isolate nano-composite 贵阳学院 2024-08-20 CN disclosed
CN-106501535-B A kind of kit of the compound releasing agent of ANS salt and detection Blood cortisol 迪瑞医疗科技股份有限公司 2018-11-09 CN disclosed
CN-107362354-A A kind of oral insulin nanometer formulation and preparation method thereof 复旦大学 2017-11-21 CN disclosed
CN-106501535-A A kind of compound releasing agent of ANS salt and the kit for detecting Blood cortisol 长春迪瑞医疗科技股份有限公司 2017-03-15 CN disclosed
US-8772540-B2 Thermal responsive molecule KYUSHU UNIVERSITY, NATIONAL UNIVERSITY CORPORATION (JP) 2014-07-08 US disclosed
US-20110124916-A1 THERMAL RESPONSIVE MOLECULE KYUSHU UNIVERSITY, NATIONAL UNIVERSITY CORPORATION (JP) 2011-05-26 US disclosed
EP-0236768-B1 MULTI-LAYERED ELEMENT FOR QUANTITATIVE ANALYSIS OF IMMUNO-REACTANT FUJI PHOTO FILM CO., LTD. (JP) 1990-09-26 EP disclosed
EP-0236768-A1 Multi-layered element for quantitative analysis of immuno-reactant FUJI PHOTO FILM CO., LTD. (JP) 1987-09-16 EP disclosed
US-4486347-A Flame retarding antimicrobial halogenated azo dyestuffs TSENTRALNY NAUCHNOISSLEDOVATELSKY INSTITUT SHERSTI (SU) 1984-12-04 US disclosed
US-4018883-A PRECIPITATION OF ANTIBODIES WITH POLYOXYETHYLENE GLYCOL NICHOLS INSTITUTE FOR ENDOCRINOLOGY (US) 1977-04-19 US disclosed
US-3995019-A FOR RADIOIMMUNOASSAY CONSISTING OF A SPECIFIC ANTIBODY RADIOLABELED, ANTIGEN, POLYETHYLENE GLYCOL, AND GAMMA GLOBULIN BAXTER TRAVENOL LABORATORIES, INC. (US) 1976-11-30 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 (2 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-20260085262-A1 ACQ FLUORESCENCE PROBE COMPOSITION, CMC DETERMINATION METHOD, STAIN CLEANING CONCENTRATION DETERMINATION METHOD, DETERGENT DISPENSING CONTROL METHOD, AND DETERGENT DISPENSING CONTROL SYSTEM BAG2, HSPA2, HSPBP1 P2RY12 3272/4885P2RY2 2644/4885P2RY4 2569/4885
US-20110124916-A1 THERMAL RESPONSIVE MOLECULE HEATR1, HEATR6, HSPH1 P2RY12 3269/4885P2RY2 3357/4885P2RY4 3222/4885

“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.