SCHEMBL4248879

SCHEMBL4248879

[N-]=[N+]=N.[N-]=[N+]=[N-].[Na+]

nearest known ligand 0.00

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.

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL5382582 0.94
SCHEMBL121695 0.94
SCHEMBL1560310 0.94 CA1 (0.86)
Hydrogen Sulfide SCHEMBL1276869 0.88 CA1 (0.75)
SCHEMBL15864291 0.88 CA1 (0.75)
SCHEMBL15864274 0.88 CA1 (0.75)
SCHEMBL15864347 0.88 CA1 (0.75)
SCHEMBL16703451 0.88
SCHEMBL3243495 0.88 CA1 (0.75)
SCHEMBL16531901 0.88

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 19 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116621900-B Tetravalent platinum aminohexose complex based on regulation and control of Mucin type O-glycosylation targeting CRPC and application thereof 河南大学 2024-05-07 CN claimed
CN-116621900-A Tetravalent platinum aminohexose complex based on regulation and control of Mucin type O-glycosylation targeting CRPC and application thereof 河南大学 2023-08-22 CN claimed
CN-115632310-A High-voltage solid soft starting cabinet with heat dissipation function 襄阳忠东机电设备有限公司 2023-01-20 CN claimed
US-20250091050-A1 OPTIMIZED SEQUENCING SYSTEMS AND METHODS ULTIMA GENOMICS INC (US) 2025-03-20 US disclosed
CN-116621900-B Tetravalent platinum aminohexose complex based on regulation and control of Mucin type O-glycosylation targeting CRPC and application thereof 河南大学 2024-05-07 CN disclosed
WO-2023192403-A2 OPTIMIZED SEQUENCING SYSTEMS AND METHODS ULTIMA GENOMICS, INC. (US) 2023-10-05 WO disclosed
CN-116621900-A Tetravalent platinum aminohexose complex based on regulation and control of Mucin type O-glycosylation targeting CRPC and application thereof 河南大学 2023-08-22 CN disclosed
US-20230128195-A1 SYNTHESIS OF HALICHONDRINS PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2023-04-27 US disclosed
EP-4169924-A2 SYNTHESIS OF HALICHONDRINS President And Fellows Of Harvard College (US) 2023-04-26 EP disclosed
US-11548898-B2 Synthesis of halichondrins PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2023-01-10 US disclosed
EP-3649135-B1 SYNTHESIS OF HALICHONDRINS HARVARD COLLEGE (US) 2022-12-28 EP disclosed
US-20210230177-A1 SYNTHESIS OF HALICHONDRINS PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2021-07-29 US disclosed
EP-3649135-A1 SYNTHESIS OF HALICHONDRINS President and Fellows of Harvard College (US) 2020-05-13 EP disclosed
WO-2019010363-A1 SYNTHESIS OF HALICHONDRINS PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2019-01-10 WO disclosed
CN-105263921-B Terazololine-one compound and its application 住友化学株式会社 2017-07-21 CN disclosed
US-8617834-B2 Thromboplastin reagent with long-term stability SIEMENS HEALTHCARE DIAGNOSTICS PRODUCTS GMBH (DE) 2013-12-31 US disclosed
US-20090182140-A1 Alicyclic Heterocyclic Compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-07-16 US disclosed
US-20090162880-A1 THROMBOPLASTIN REAGENT WITH LONG-TERM STABILITY SIEMENS HEALTHCARE DIAGNOSTICS PRODUCTS GMBH (DE) 2009-06-25 US disclosed
EP-1970373-A1 ALICYCLIC HETEROCYCLIC COMPOUND Mitsubishi Tanabe Pharma Corporation (JP) 2008-09-17 EP disclosed