SCHEMBL2056633

SCHEMBL2056633

Clc1ccc([B-](c2ccc(Cl)cc2)(c2ccc(Cl)cc2)c2ccc(Cl)cc2)cc1.[Na+]

nearest known ligand 0.53

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 4/20 0.36
CA2 known ✓ P00918 4/20 0.36
CA12 known ✓ O43570 1/20 0.32
CA4 known ✓ P22748 1/20 0.32
LMNA P02545 2/20 0.53
CYP2A6 P11509 1/20 0.53
CYP1A2 P05177 1/20 0.43
IDO1 P14902 2/20 0.40
TSHR P16473 6/20 0.38
MAPK1 P28482 5/20 0.38
HIF1A Q16665 3/20 0.38
CYP3A4 P08684 2/20 0.35
CES2 O00748 1/20 0.35
CES1 P23141 1/20 0.35
ENPP2 Q13822 1/20 0.35
ALDH1A1 P00352 1/20 0.35
HSD17B10 Q99714 1/20 0.35
TDP1 Q9NUW8 2/20 0.33
ALOX15 P16050 1/20 0.33
ATM Q13315 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
SCHEMBL337270 0.97 LMNA (0.57) LMNACYP2A6CYP1A2IDO1TSHR
SCHEMBL5167685 0.93 LMNA (0.53) LMNACYP2A6CYP1A2IDO1TSHR
Potassium Ion SCHEMBL259262 0.93 LMNA (0.53) LMNACYP2A6CYP1A2IDO1TSHR
Ammonia Solution, Strong SCHEMBL2467561 0.93 LMNA (0.53) LMNACYP2A6CYP1A2IDO1TSHR
Silver SCHEMBL9414198 0.93 LMNA (0.53) LMNACYP2A6CYP1A2IDO1TSHR
SCHEMBL25280488 0.93 LMNA (0.53) LMNACYP2A6CYP1A2IDO1TSHR
SCHEMBL7146462 0.93 LMNA (0.53) LMNACYP2A6CYP1A2IDO1TSHR
Potassium SCHEMBL31218525 0.90 LMNA (0.50) LMNACYP2A6CYP1A2IDO1TSHR
Silver SCHEMBL9414202 0.90 LMNA (0.50) LMNACYP2A6CYP1A2IDO1TSHR
SCHEMBL5972567 0.85 CYP1A2 (0.57) LMNACYP2A6CYP1A2IDO1TSHR

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 52 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4747611-A1 OPTICAL ELECTRODE ANALYTE DETECTION SYSTEM AND METHODS OF USE Vital Biosciences Inc. (CA) 2026-05-27 EP claimed
US-12601705-B2 Sensor for measuring ionized magnesium INSTRUMENTATION LABORATORY COMPANY (US) 2026-04-14 US claimed
EP-4476537-B1 SENSOR FOR MEASURING IONIZED MAGNESIUM INSTR LABORATORY CO (US) 2025-10-29 EP claimed
WO-2025022286-A1 OPTICAL ELECTRODE ANALYTE DETECTION SYSTEM AND METHODS OF USE VITAL BIOSCIENCES INC. (CA) 2025-01-30 WO claimed
EP-4476537-A1 SENSOR FOR MEASURING IONIZED MAGNESIUM Instrumentation Laboratory Company (US) 2024-12-18 EP claimed
WO-2024196901-A2 A HIGH THROUGHPUT ION-SENSING METHOD WHITESIDES GEORGE M (US) 2024-09-26 WO claimed
US-20230304960-A1 SENSOR FOR MEASURING IONIZED MAGNESIUM INSTRUMENTATION LABORATORY COMPANY 2023-09-28 US claimed
WO-2023154326-A1 SENSOR FOR MEASURING IONIZED MAGNESIUM INSTRUMENTATION LABORATORY COMPANY (US) 2023-08-17 WO claimed
EP-2473476-B1 Tetraarylborate method for producing substituted biphenyls BAYER IP GMBH (DE) 2015-01-14 EP claimed
US-8436211-B2 Tetraarylborate process for the preparation of substituted biphenyls BAYER CROPSCIENCE AG (DE) 2013-05-07 US claimed
US-20110105796-A1 Tetraarylborate Process for the Preparation of Substituted Biphenyls BAYER CROPSCIENCE AG (DE) 2011-05-05 US claimed
US-5133856-A Ion sensor TERUMO KABUSHIKI KAISHA (JP) 1992-07-28 US claimed
EP-0186210-B1 Ion sensor TERUMO KABUSHIKI KAISHA trading as TERUMO CORPORATION (JP) 1992-04-22 EP claimed
EP-0186210-A2 Ion sensor TERUMO KABUSHIKI KAISHA trading as TERUMO CORPORATION (JP) 1986-07-02 EP claimed
EP-4747611-A1 OPTICAL ELECTRODE ANALYTE DETECTION SYSTEM AND METHODS OF USE Vital Biosciences Inc. (CA) 2026-05-27 EP disclosed
US-12601705-B2 Sensor for measuring ionized magnesium INSTRUMENTATION LABORATORY COMPANY (US) 2026-04-14 US disclosed
EP-4235163-B1 SENSOR INCLUDING A REFERENCE ELECTRODE SYSMEX CORP (JP) 2026-03-11 EP disclosed
US-4816118-A MULTILAYER-ISOLATION MEMBRANE, ION SENSITIVE COATING TERUMO CORPORATION (JP) 1989-03-28 US disclosed
EP-0221508-A1 Sodium ion selective electrode HITACHI, LTD. (JP) 1987-05-13 EP disclosed
EP-0186210-A2 Ion sensor TERUMO KABUSHIKI KAISHA trading as TERUMO CORPORATION (JP) 1986-07-02 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-12601705-B2 Sensor for measuring ionized magnesium MAG, S100B, S100P CA1 237/4885CA2 27/4885CA12 177/4885
US-20110105796-A1 Tetraarylborate Process for the Preparation of Substituted Biphenyls AHR, DDT, CYP4F3 CA1 4783/4885CA2 4722/4885CA12 3886/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.