SCHEMBL340738

SCHEMBL340738

O=C1C=Cc2cc(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c2/C1=N/Nc1ccccc1.[Na+].[Na+]

nearest known ligand 0.36

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
P2RY12 known ✓ Q9H244 7/20 0.35
P2RY2 known ✓ P41231 4/20 0.35
P2RY4 known ✓ P51582 3/20 0.35
P2RY6 known ✓ Q15077 3/20 0.35
P2RY1 known ✓ P47900 2/20 0.35
ALDH1A1 P00352 3/20 0.36
HTT P42858 1/20 0.36
CDK2 P24941 2/20 0.35
APP P05067 1/20 0.33
DEPTOR Q8TB45 1/20 0.33
RAD51 Q06609 1/20 0.32
PKLR P30613 2/20 0.32
GFER P55789 2/20 0.31
GAA P10253 2/20 0.31
KMT2A Q03164 2/20 0.31
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
LMNA P02545 1/20 0.30
POLB P06746 1/20 0.30

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
SCHEMBL340440 0.92 APP (0.41) ALDH1A1HTTP2RY12P2RY2P2RY4
SCHEMBL340899 0.84 THRB (0.34) ALDH1A1P2RY12GAAKMT2AMEN1
SCHEMBL31679136 0.84 THRB (0.34) ALDH1A1P2RY12GAAKMT2AMEN1
SCHEMBL15115318 0.82 ALDH1A1 (0.37) ALDH1A1HTTCDK2DEPTORGFER
SCHEMBL2865909 0.82 HTT (0.39) ALDH1A1HTTP2RY12P2RY2P2RY4
SCHEMBL340828 0.74 EIF2AK2 (0.35) ALDH1A1P2RY12GAALMNAMAPT
SCHEMBL21055662 0.74 ALDH1A1 (0.41) ALDH1A1HTTP2RY12P2RY2P2RY4
SCHEMBL342135 0.74 MAPT (0.35) ALDH1A1HTTP2RY12P2RY2P2RY4
SCHEMBL15113039 0.73 TTR (0.40) ALDH1A1HTTP2RY4CDK2DEPTOR
SCHEMBL21436655 0.72 ALDH1A1 (0.41) ALDH1A1HTTP2RY12DEPTORPKLR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0743523-B1 Dye-based reference material, preparation and use thereof BAYER AG (US) 2002-08-28 EP claimed
US-20260043720-A1 STABILIZED TWO-PART HEMATOXYLIN SOLUTION UTILIZING pH ADJUSTMENT VENTANA MED SYST INC (US) 2026-02-12 US disclosed
US-20250377301-A1 STABILISED FLUOROPHORES, COMPOSITIONS, METHODS OF PREPARATION, CONJUGATES THEREOF, AND METHODS OF USE FREISTAAT BAYERN LUDWIG MAXIMILIANS UNIV MUENCHEN (DE) 2025-12-11 US disclosed
US-12474240-B2 Stabilized two-part hematoxylin solution utilizing pH adjustment VENTANA MEDICAL SYSTEMS, INC. (US) 2025-11-18 US disclosed
CN-118841644-A Application of dye molecule as additive in preparation of electrolyte 中山大学 2024-10-25 CN disclosed
US-20230097824-A1 SEMI-SYNTHESIS AND USE OF RACEMIC HEMATOXYLIN ROCHE DIAGNOSTICS GMBH (DE) 2023-03-30 US disclosed
EP-4147024-A2 SEMI-SYNTHESIS AND USE OF RACEMIC HEMATOXYLIN Ventana Medical Systems, Inc. (US) 2023-03-15 EP disclosed
CN-115552214-A Semi-synthesis and use of racemic hematoxylin 文塔纳医疗系统公司 2022-12-30 CN disclosed
WO-2022188373-A1 METHOD FOR DETECTING WATER-SOLUBLE ANIONIC SYNTHETIC PIGMENT IN FOOD 广州市食品检验所(广州市酒类检测中心) 2022-09-15 WO disclosed
EP-3622266-B1 STABILIZED TWO-PART HEMATOXYLIN SOLUTION UTILIZING PH ADJUSTMENT, METHOD FOR STAINING AND KIT VENTANA MED SYST INC (US) 2022-08-17 EP disclosed
US-7713472-B2 Antiseptic derivatives with broad spectrum antimicrobial activity for the impregnation of surfaces BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2010-05-11 US disclosed
US-7651661-B2 Medical devices with broad spectrum antimicrobial activity BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2010-01-26 US disclosed
EP-2092385-A1 ILLUMINATION SOURCE COMPRISING LIGHT EMITTING DIODES FOR STAINED BIOLOGICAL SAMPLES Cytyc Corporation (US) 2009-08-26 EP disclosed
US-7561329-B2 Illumination source for stained biological samples CYTYC CORPORATION (US) 2009-07-14 US disclosed
US-20080183152-A1 MEDICAL DEVICES WITH BROAD SPECTRUM ANTIMICROBIAL ACTIVITY RAAD ISSAM 2008-07-31 US disclosed
WO-2008073728-A1 ILLUMINATION SOURCE COMPRISING LIGHT EMITTING DIODES FOR STAINED BIOLOGICAL SAMPLES CYTYC CORPORATION (US) 2008-06-19 WO disclosed
US-20080144169-A1 ILLUMINATION SOURCE FOR STAINED BIOLOGICAL SAMPLES CYTYC CORPORATION (US) 2008-06-19 US disclosed
US-20070154621-A1 METHODS FOR COATING SURFACES WITH ANTIMICROBIAL AGENTS THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM 2007-07-05 US disclosed
US-20050197634-A1 Methods for coating and impregnating medical devices with antiseptic compositions BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2005-09-08 US disclosed
US-4550016-A STAINED SPECIMEN HAVING CONTRAST AND COLORATION; RAPID DIAGNOSIS HARRIS CYNTHIA J 1985-10-29 US 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-20250377301-A1 STABILISED FLUOROPHORES, COMPOSITIONS, METHODS OF PREPARATION, CONJUGATES THEREOF, AND METHODS OF USE CRY1, MKI67, IK P2RY12 2136/4885P2RY2 2822/4885P2RY4 2925/4885
US-20260043720-A1 STABILIZED TWO-PART HEMATOXYLIN SOLUTION UTILIZING pH ADJUSTMENT SMCHD1, KIT, CD68 P2RY12 2144/4885P2RY2 3036/4885P2RY4 3759/4885

“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.