SCHEMBL135430

SCHEMBL135430

[Na+].c1ccc([B-](c2ccccc2)(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.47

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
CA1 known ✓ P00915 2/20 0.33
CA2 known ✓ P00918 2/20 0.33
CA12 known ✓ O43570 1/20 0.33
CA4 known ✓ P22748 1/20 0.33
THRB known ✓ P10828 1/20 0.33
ALDH1A1 P00352 4/20 0.47
MAPK1 P28482 2/20 0.35
RAB9A P51151 2/20 0.35
NPC1 O15118 1/20 0.35
TSHR P16473 4/20 0.33
TDP1 Q9NUW8 3/20 0.33
LMNA P02545 3/20 0.33
MAPT P10636 3/20 0.33
CA9 Q16790 2/20 0.33
HSD17B10 Q99714 2/20 0.33
GLA P06280 1/20 0.33
CA3 P07451 1/20 0.33
CA14 Q9ULX7 1/20 0.33
ALOX12 P18054 1/20 0.33
ACHE P22303 1/20 0.33

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
SCHEMBL30069233 1.00 ALDH1A1 (0.47) ALDH1A1MAPK1RAB9ANPC1TSHR
SCHEMBL10380822 1.00 ALDH1A1 (0.47) ALDH1A1MAPK1RAB9ANPC1TSHR
SCHEMBL28266166 0.96 ALDH1A1 (0.44) ALDH1A1MAPK1RAB9ANPC1TSHR
Water SCHEMBL27925219 0.96 ALDH1A1 (0.44) ALDH1A1MAPK1RAB9ANPC1TSHR
Potassium Ion SCHEMBL28138096 0.96 ALDH1A1 (0.44) ALDH1A1MAPK1RAB9ANPC1TSHR
SCHEMBL11707018 0.96 ALDH1A1 (0.50) ALDH1A1MAPK1RAB9ANPC1TSHR
SCHEMBL143876 0.96 ALDH1A1 (0.50) ALDH1A1MAPK1RAB9ANPC1TSHR
Benzene SCHEMBL31091106 0.96 ALDH1A1 (0.50) ALDH1A1MAPK1RAB9ANPC1TSHR
SCHEMBL225363 0.92 ALDH1A1 (0.47) ALDH1A1MAPK1RAB9ANPC1TSHR
Ammonia Solution, Strong SCHEMBL234555 0.92 ALDH1A1 (0.47) ALDH1A1MAPK1RAB9ANPC1TSHR

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 5046 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122081653-A Method for extracting rubidium and cesium from metal ion wastewater and separating potassium and sodium 2026-05-26 CN claimed
CN-122073248-A Sodium ion battery 深圳新宙邦科技股份有限公司 2026-05-22 CN claimed
CN-122037467-A High-uniformity high-stability epoxy modified resin and preparation method thereof 苏州三烁化学有限公司 2026-05-15 CN claimed
CN-116487711-B Sodium ion battery electrolyte and sodium ion battery with high initial efficiency and long circulation 深圳新宙邦科技股份有限公司 2026-05-15 CN claimed
CN-122029627-A Electrolyte composition for sodium-based battery and method for manufacturing same 科罗拉多州立大学董事会 2026-05-12 CN claimed
US-12601705-B2 Sensor for measuring ionized magnesium INSTRUMENTATION LABORATORY COMPANY (US) 2026-04-14 US claimed
US-20260031398-A1 SODIUM-ION BATTERY ELECTROLYTE AND SODIUM-ION BATTERY SHENZHEN CAPCHEM TECHNOLOGY CO LTD (CN) 2026-01-29 US claimed
US-20260024804-A1 ELECTROLYTE, SECONDARY BATTERY, AND ELECTRIC APPARATUS CONTEMPORARY AMPEREX TECHNOLOGY CO LTD (CN) 2026-01-22 US claimed
US-20250391909-A1 SODIUM ION SECONDARY BATTERY SHENZHEN CAPCHEM TECHNOLOGY CO LTD (CN) 2025-12-25 US claimed
EP-4308919-B1 ANALYSIS SYSTEM FOR THE DETERMINATION OF IONS IN AN ION-CONTAINING LIQUID MEDIUM, AND ANALYSIS METHOD DIMETAMUS UG HAFTUNGSBESCHRAENKT (DE) 2025-12-24 EP claimed
WO-1988004834-A1 SECONDARY BATTERY THE DOW CHEMICAL COMPANY (US) 1988-06-30 WO claimed
US-4714665-A Secondary battery THE DOW CHEMICAL COMPANY (US) 1987-12-22 US claimed
EP-0221508-A1 Sodium ion selective electrode HITACHI, LTD. (JP) 1987-05-13 EP claimed
US-4647440-A HETEROPOLYACID ADDUCT OF CROWN ETHER KERNFORSCHUNGSZENTRUM KARLSRUHE GMBH (DE) 1987-03-03 US claimed
EP-0073263-B1 PROCESS FOR SEPARATING CESIUM IONS FROM AQUEOUS SOLUTIONS KERNFORSCHUNGSZENTRUM KARLSRUHE GMBH (DE) 1985-12-04 EP claimed
US-4500569-A REDUCTION OF ADDUCT TO GIVE CATALYTICALLY ACTIVE SURFACE OF PALLADIUM MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1985-02-19 US claimed
EP-0042210-B1 PALLADIUM(II) BIS (HEXAFLUOROACETYLACETONATE), ADDUCTS DERIVED THEREFROM AND USES THEREOF MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1984-08-01 EP claimed
US-4410569-A ELECTROLESS PLATING MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1983-10-18 US claimed
EP-0042210-A2 Palladium(II) bis (hexafluoroacetylacetonate), adducts derived therefrom and uses thereof MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1981-12-23 EP claimed
US-4183825-A BY A BASE CONOCO, INC. (US) 1980-01-15 US claimed