SCHEMBL144504

SCHEMBL144504

O=S(=O)([O-])c1ccc(N=Nc2c(O)ccc3ccccc23)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
SCHEMBL29378285 1.00 MAPT (0.78) MAPTKMT2AMEN1THRBTDP1
SCHEMBL339399 1.00 MAPT (0.78) MAPTKMT2AMEN1THRBTDP1
SCHEMBL29353711 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 172 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4528210-A2 TRACER PROJECTILE HAVING AT LEAST ONE COLOUR CHANGE RWS GmbH (DE) 2025-03-26 — — EP claimed
EP-2930126-B1 Fashionable aerosol dye HENKEL AG & CO KGAA (DE) 2019-10-09 — — EP claimed
WO-2008082694-A2 ORGANELLES IN BIOANODES, BIOCATHODES, AND BIOFUEL CELLS AKERMIN, INC. (US) 2008-07-10 — — WO claimed
US-7294370-B2 Polarizing and optical compensating films for visible, ultraviolet and infrared parts of the electromagnetic spectrum KENT STATE UNIVERSITY (US) 2007-11-13 — — US claimed
EP-4528210-A2 TRACER PROJECTILE HAVING AT LEAST ONE COLOUR CHANGE RWS GmbH (DE) 2025-03-26 — — EP disclosed
EP-3172266-B1 METHOD FOR MODIFYING THE SURFACE PROPERTIES OF ELASTOMER CELLULAR FOAMS UNIV STRASBOURG (FR) 2024-07-03 — — EP disclosed
EP-3229918-B1 COMPOSITION AND PROCEDURE FOR TREATING KERATINIC FIBERS WITH FLASH EVAPORATION HENKEL AG & CO KGAA (DE) 2024-03-13 — — EP disclosed
WO-2023180560-A1 COMPOSITION FOR ENHANCING KERATIN FIBERS WELLA GERMANY GMBH (DE) 2023-09-28 — — WO disclosed
WO-2023067176-A1 WATER REDUCED COMPACT SHAMPOO COMPOSITION WELLA GERMANY GMBH (DE) 2023-04-27 — — WO disclosed
WO-2023066503-A1 WATER REDUCED COMPACT SHAMPOO COMPOSITION WELLA GERMANY GMBH (DE) 2023-04-27 — — WO disclosed
WO-2023066502-A1 WATER REDUCED COMPACT CONDITIONER COMPOSITION WELLA GERMANY GMBH (DE) 2023-04-27 — — WO disclosed
WO-2023067173-A1 WATER REDUCED COMPACT CONDITIONER COMPOSITION WELLA GERMANY GMBH (DE) 2023-04-27 — — WO disclosed
US-5364466-A Polymer scale preventive agent, polymerization vessel effective in preventing polymer scale deposition, and process of producing polymer using said vessel SHIN-ETSU CHEMICAL CO., LTD. (JP) 1994-11-15 — — US disclosed
EP-0595226-A2 Active substance-containing polymer gel HOYA CORPORATION (JP) 1994-05-04 — — EP disclosed
US-5302639-A Mixtures of nitrogen containing organic compound, anionic compound and a vinylpyrrolidone polymer SHIN-ETSU CHEMICAL CO., LTD. (JP) 1994-04-12 — — US disclosed
EP-0482593-A1 Polymer scale preventive agent, polymerization vessel for preventing polymer scale deposition, and process of producing polymer using said vessel SHIN-ETSU CHEMICAL CO., LTD. (JP) 1992-04-29 — — EP disclosed
US-4784959-A Method of detecting hydrocarbon fuel leaks LOCKHEED CORPORATION (US) 1988-11-15 — — US disclosed
US-4756854-A Method and apparatus for detecting hydrocarbon fuel leaks LOCKHEED CORPORATION (US) 1988-07-12 — — US disclosed
US-4745797-A Method and apparatus for detecting hydrocarbon fuel leaks LOCKHEED CORPORATION (US) 1988-05-24 — — US disclosed
US-4615828-A Method and apparatus for detecting hydrocarbon fuel leaks LOCKHEED CORPORATION (US) 1986-10-07 — — US disclosed
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