SCHEMBL135508

SCHEMBL135508

O=C([O-])c1cc(/N=N/c2ccc(/N=N/c3ccc(S(=O)(=O)[O-])cc3)cc2)ccc1O.[Na+].[Na+]

nearest known ligand 0.61

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
PTGS2 known ✓ P35354 4/20 0.58
PTGS1 known ✓ P23219 3/20 0.58
THRB known ✓ P10828 2/20 0.53
PDE4A known ✓ P27815 1/20 0.51
CA2 known ✓ P00918 2/20 0.44
CA1 known ✓ P00915 1/20 0.44
CA12 known ✓ O43570 1/20 0.42
PLCG1 P19174 1/20 0.61
PHLPP2 Q6ZVD8 5/20 0.58
ALDH1A1 P00352 4/20 0.58
CYP2C9 P11712 2/20 0.58
HSD17B10 Q99714 1/20 0.58
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
BLVRB P30043 2/20 0.51
KDR P35968 1/20 0.51
HTT P42858 1/20 0.51
TDP1 Q9NUW8 2/20 0.50
APP P05067 2/20 0.50
RECQL P46063 1/20 0.50

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
SCHEMBL428681 1.00 PLCG1 (0.61) PLCG1PHLPP2PTGS2ALDH1A1PTGS1
SCHEMBL27727543 0.88 PHLPP2 (0.60) PLCG1PHLPP2PTGS2ALDH1A1PTGS1
Olsalazine SCHEMBL29767 0.87 MEN1 (0.66) PLCG1PHLPP2PTGS2ALDH1A1PTGS1
Olsalazine SCHEMBL3476110 0.87 MEN1 (0.66) PLCG1PHLPP2PTGS2ALDH1A1PTGS1
Olsalazine SCHEMBL29454399 0.87 MEN1 (0.66) PLCG1PHLPP2PTGS2ALDH1A1PTGS1
SCHEMBL17866569 0.84 ALDH1A1 (0.48) PLCG1PHLPP2PTGS2ALDH1A1PTGS1
Chrysamine G SCHEMBL15818024 0.84 TDP1 (0.70) PLCG1PHLPP2PTGS2ALDH1A1PTGS1
SCHEMBL29950230 0.83 MEN1 (0.61) PHLPP2PTGS2ALDH1A1PTGS1CYP2C9
SCHEMBL27985065 0.83 MEN1 (0.61) PHLPP2PTGS2ALDH1A1PTGS1CYP2C9
SCHEMBL10784910 0.82 MEN1 (0.59) PLCG1PHLPP2PTGS2ALDH1A1PTGS1

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

Appears in 3133 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4391829-A1 MEAT-ANALOGUE COMPOSITION AAK AB (publ) (SE) 2024-07-03 EP claimed
CN-117888376-A Energy-saving and low-loss printing and dyeing process of cotton fiber textile fabric 安徽颍育精致纺织科技有限公司 2024-04-16 CN claimed
CN-114197226-B Preparation method of colored bacterial cellulose 嘉兴学院 2024-01-09 CN claimed
CN-114108336-B Preparation method of color bacterial cellulose mask 嘉兴学院 2023-10-20 CN claimed
CN-115679691-B Environment-friendly printing and dyeing process for cotton woven fabric 绍兴南鹰纺织印染有限公司 2023-08-18 CN claimed
CN-116272848-A Granular coal gasification fine slag-based adsorption material, preparation method and application 陕煤集团榆林化学有限责任公司 2023-06-23 CN claimed
EP-4143267-A1 WATER-BASED INK COMPOSITION WITH COLOR-CHANGING BY EVAPORATION Société BIC (FR) 2023-03-08 EP claimed
WO-2023027624-A1 MEAT-ANALOGUE COMPOSITION AAK AB (SE) 2023-03-02 WO claimed
CN-115679691-A Environment-friendly printing and dyeing process of cotton woven fabric 绍兴南鹰纺织印染有限公司 2023-02-03 CN claimed
CN-115364817-A Preparation method and application of rabbit skin gelatin adsorption beads 天津工业大学 2022-11-22 CN claimed
US-PP6440-P Lilium compass BISCHOFF TULLEKEN LELIECULTUUR B.V. (NL) 1988-12-06 US claimed
US-PP5792-P Lily plant named Orange Pixie MELRIDGE INC. (US) 1986-10-21 US claimed
US-PP5667-P Kalanchoe plant named Durango PAN AMERICAN PLANT COMPANY (US) 1986-02-18 US claimed
US-PP5007-P Lily plant: Lilium `Picasso` MELRIDGE, INC. (US) 1983-03-22 US claimed
US-PP5006-P Lily plant: Lilium Inferno MELRIDGE, INC. (US) 1983-03-22 US claimed
US-PP4879-P Lily plant: Lilium `Matchless` CEBECO LILIES INC. 1982-08-24 US claimed
US-4214401-A Simulated burner for a toy cooking range THE QUAKER OATS COMPANY (US) 1980-07-29 US claimed
US-PP4309-P Rose plant MCGREDY SAMUEL D (NZ) 1978-09-26 US claimed
US-4093612-A ADSORPTION ONTO IMMOBILIZED DYES RESEARCH CORPORATION (US) 1978-06-06 US claimed
US-4016149-A ABSORTION ONTO A COLOR REACTIVE DYE-SOLID PHASE SUPPORT RESEARCH CORPORATION (US) 1977-04-05 US claimed