SCHEMBL93542

SCHEMBL93542

[H+].[Na+].[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
SCHEMBL10578665 1.00
SCHEMBL27657 1.00
SCHEMBL7457068 1.00
SCHEMBL8333775 1.00
SCHEMBL157767 1.00
SCHEMBL1410012 1.00
SCHEMBL442743 1.00
SCHEMBL11525437 1.00
SCHEMBL8333713 1.00
Fluoride Ion SCHEMBL35953 0.82

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 5842 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118243884-A Dissolution medium and dissolution measurement method of flupentixol and melitracen compound preparation 成都倍特药业股份有限公司 2024-06-25 CN claimed
CN-117887761-A Recombinant single-chain antibody for resisting 25-OH vitamin D3 as well as preparation and application thereof 厦门康基生物科技有限公司 2024-04-16 CN claimed
CN-117659760-A Special flame retardant for water-based flame retardant coating and preparation method thereof 山东泰星新材料股份有限公司 2024-03-08 CN claimed
CN-117288966-B Kit for combined detection of IGF-1 and IGFBP-3 and lysate and buffer solution used by kit 山东康华生物医疗科技股份有限公司 2024-02-27 CN claimed
CN-117288966-A Kit for combined detection of IGF-1 and IGFBP-3 and lysate and buffer solution used by kit 山东康华生物医疗科技股份有限公司 2023-12-26 CN claimed
CN-117192098-A Analytical buffer solution, preparation method thereof and kit for determining carbohydrate antigen 72-4 四川沃文特生物技术有限公司 2023-12-08 CN claimed
CN-116829172-A Treatment method of stable liraglutide pharmaceutical preparation 杭州九源基因工程有限公司 2023-09-29 CN claimed
CN-114452258-B Liraglutide liposome preparation and preparation method and application thereof 成都大学 2023-07-25 CN claimed
WO-2023125434-A1 COVERED STENT SYSTEM AND PREPARATION METHOD THEREFOR 元心科技(深圳)有限公司 2023-07-06 WO claimed
CN-116295834-A On-line monitoring method for apparent stability of biological product in chromatographic process 上海迈晋生物医药科技有限公司 2023-06-23 CN claimed
US-20030216302-A1 Stable aqueous composition of a peptide SUN PHARMACEUTICAL INDUSTRIES LIMITED (IN) 2003-11-20 US claimed
EP-1246668-A1 AN RAPID ACTING FREEZE DIRED ORAL PHARMACEUTICAL COMPOSITION FOR TREATING MIGRAINE Natco Pharma Limited (IN) 2002-10-09 EP claimed
EP-1191926-A1 NEW FORMULATION AstraZeneca AB (SE) 2002-04-03 EP claimed
WO-2001039836-A1 A RAPID ACTING FREEZE DIRED ORAL PHARMACEUTICAL COMPOSITION FOR TREATING MIGRAINE NATCO PHARMA LIMITED (IN) 2001-06-07 WO claimed
WO-2000078293-A1 NEW FORMULATION ASTRAZENECA AB (SE) 2000-12-28 WO claimed
CN-1087876-A A kind of compound regenerator used in hard water softener WU MING (CN) 1994-06-15 CN claimed
WO-1993007851-A1 BUFFERING SYSTEM FOR ANTICALCULUS DENTIFRICES CHURCH & DWIGHT COMPANY, INC. (US) 1993-04-29 WO claimed
US-5009759-A Methods for producing agarose gels having variable pore sizes BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 1991-04-23 US claimed
US-4604350-A USING SOLUTION OF GLYCEROL, SODIUM CHLORIDE, SODIUM DIHYDROGEN PHOSPHATE, DISODIUM HYDROGEN PHOSPHATE, SODIUM AZIDE, AND ACID GREEN DYE MATTEIS MARIA C DE 1986-08-05 US claimed
EP-0036274-A2 Methods of monitoring micro-organisms and media for culture JAPAN TECTRON INSTRUMENTS CORPORATION (JP) 1981-09-23 EP claimed