SCHEMBL29378285

SCHEMBL29378285

O=S(=O)([O-])c1ccc(N=Nc2ccc(N=Nc3c(O)ccc4ccccc34)cc2)cc1.[Na+]

nearest known ligand 0.78

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 4/20 0.76
▸ MAPT P10636 9/20 0.78
▸ KMT2A Q03164 6/20 0.78
▸ MEN1 O00255 5/20 0.78
▸ TDP1 Q9NUW8 6/20 0.67
▸ L3MBTL1 Q9Y468 4/20 0.67
▸ GAA P10253 2/20 0.67
▸ LMNA P02545 2/20 0.67
▸ HSP90AA1 P07900 2/20 0.67
▸ ALPL P05186 1/20 0.67
▸ ALPI P09923 1/20 0.67
▸ ALPG P10696 1/20 0.67
▸ CASP3 P42574 1/20 0.67
▸ RECQL P46063 1/20 0.67
▸ MMP14 P50281 1/20 0.67
▸ SENP8 Q96LD8 1/20 0.67
▸ SENP7 Q9BQF6 1/20 0.67
▸ SENP6 Q9GZR1 1/20 0.67
▸ MAPK1 P28482 4/20 0.63
▸ GLO1 Q04760 2/20 0.61

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
SCHEMBL339399 1.00 MAPT (0.78) MAPTKMT2AMEN1THRBTDP1
SCHEMBL29353711 1.00 MAPT (0.78) MAPTKMT2AMEN1THRBTDP1
SCHEMBL144504 1.00 MAPT (0.78) MAPTKMT2AMEN1THRBTDP1
SCHEMBL16322715 0.97 MAPT (0.78) MAPTKMT2AMEN1THRBTDP1
SCHEMBL16322716 0.97 MAPT (0.78) MAPTKMT2AMEN1THRBTDP1
SCHEMBL30842302 0.89 MAPT (0.78) MAPTKMT2AMEN1THRBTDP1
SCHEMBL136632 0.89 THRB (0.64) MAPTKMT2AMEN1THRBTDP1
SCHEMBL29423647 0.89 THRB (0.64) MAPTKMT2AMEN1THRBTDP1
SCHEMBL11336943 0.87 MAPT (0.80) MAPTKMT2AMEN1THRBTDP1
SCHEMBL29376978 0.87 MAPT (0.80) MAPTKMT2AMEN1THRBTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4403369-A1 AQUEOUS INK COMPOSITION, INK SET, PRINTED MATTER, AND PRODUCTION METHOD FOR PRINTED MATTER DIC Corporation (JP) 2024-07-24 — — EP claimed
CN-118339242-A Aqueous ink composition, ink set, printed matter, and method for producing printed matter DIC株式会社 2024-07-12 — — CN claimed
WO-2023120202-A1 AQUEOUS INK COMPOSITION, INK SET, PRINTED MATTER, AND PRODUCTION METHOD FOR PRINTED MATTER DIC株式会社 2023-06-29 — — WO claimed
CN-112946140-B Method for detecting water-soluble anion synthetic pigment in food 广州市食品检验所(广州市酒类检测中心) 2023-03-21 — — CN claimed
US-20220403193-A1 AQUEOUS INK COMPOSITION, INK SET, PRINTED MATERIAL, AND METHOD OF PRODUCING PRINTED MATERIAL DIC CORPORATION (JP) 2022-12-22 — — US claimed
EP-4067085-A1 AQUEOUS INK COMPOSITION, INKSET, PRINTED MATTER, AND METHOD FOR MANUFACTURING PRINTED MATTER DIC Corporation (JP) 2022-10-05 — — EP claimed
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 claimed
CN-114641543-A Aqueous ink composition, ink set, printed matter, and method for producing printed matter DIC株式会社 2022-06-17 — — CN claimed
EP-3980140-A2 LONG-TERM FIRE RETARDANT WITH CORROSION INHIBITORS AND METHODS FOR MAKING AND USING SAME FRS Group, LLC (US) 2022-04-13 — — EP claimed
US-12629555-B2 Long-term fire retardant with magnesium sulfate and corrosion inhibitors and methods for making and using same PERIMETER SOLUTIONS, LP (US) 2026-05-19 — — US disclosed
EP-4347710-B1 MIXER SYSTEM FOR PRODUCING AQUEOUS COATING MATERIALS BASF COATINGS GMBH (DE) 2026-05-13 — — EP disclosed
CN-122029023-A Method for producing a composite part comprising a step of non-contact application of a liquid coating composition 科思创德国股份有限公司 2026-05-12 — — CN disclosed
CN-122004563-A Article having structural color and method of making a structural colored article 耐克创新有限合伙公司 2026-05-12 — — CN disclosed
EP-4731312-A1 SYSTEMS, APPARATUS, AND METHODS FOR DILUTION AND EFFECTIVE MIXING OF HIGH VISCOSITY LONG-TERM FIRE RETARDANT LIQUID CONCENTRATES Perimeter Solutions LP (US) 2026-04-29 — — EP disclosed
CN-114080567-A Composition containing colorant 住友化学株式会社 2022-02-22 — — CN disclosed
CN-107797382-B Coloring composition 住友化学株式会社 2022-02-22 — — CN disclosed
CN-114073356-A Method for manufacturing articles using foam particles 耐克创新有限合伙公司 2022-02-22 — — CN disclosed
CN-107797381-B Coloring composition and compound 住友化学株式会社 2022-02-18 — — CN disclosed
WO-2022034498-A1 MOVING-FRONT STERILIZATION MONITORING DEVICES 3M INNOVATIVE PROPERTIES COMPANY (US) 2022-02-17 — — WO disclosed
CN-106892891-B Compound, colored curable resin composition, color filter, and liquid crystal display device 东友精细化工有限公司 2022-02-11 — — CN 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 (1 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-12629555-B2 Long-term fire retardant with magnesium sulfate and corrosion inhibitors and methods for making and using same SLC6A12, SLC9A2, SLC11A2 THRB 1787/4885MAPT 301/4885KMT2A 1426/4885

“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.

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