SCHEMBL29523045

SCHEMBL29523045

O=S(=O)([O-])c1cc(N=C=S)ccc1C=Cc1ccc(N=C=S)cc1S(=O)(=O)[O-].[Na+].[Na+]

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

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
P2RY6 known ✓ Q15077 1/20 0.70
CA1 known ✓ P00915 1/20 0.44
CA2 known ✓ P00918 1/20 0.44
RAD51 Q06609 11/20 1.00
KDM4E B2RXH2 2/20 1.00
USP2 O75604 2/20 1.00
ALDH1A1 P00352 2/20 1.00
LTA P01374 2/20 1.00
CYP3A4 P08684 2/20 1.00
MAPT P10636 2/20 1.00
HPGD P15428 2/20 1.00
P2RX3 P56373 2/20 1.00
HSD17B10 Q99714 2/20 1.00
TDP1 Q9NUW8 2/20 1.00
RAD1 O60671 1/20 0.70
APEX1 P27695 1/20 0.49
SENP3 Q9H4L4 4/20 0.38
SENP2 Q9HC62 4/20 0.38
SENP1 Q9P0U3 4/20 0.38
SUMO2 P61956 3/20 0.38

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
SCHEMBL439382 1.00 RAD51 (1.00) RAD51KDM4EUSP2ALDH1A1LTA
SCHEMBL7903158 1.00 RAD51 (1.00) RAD51KDM4EUSP2ALDH1A1LTA
SCHEMBL31196489 1.00 RAD51 (1.00) RAD51KDM4EUSP2ALDH1A1LTA
Water SCHEMBL29459684 0.98 RAD51 (0.97) RAD51KDM4EUSP2ALDH1A1LTA
SCHEMBL30889118 0.86 RAD51 (0.75) RAD51KDM4EUSP2ALDH1A1LTA
SCHEMBL2333709 0.84 RAD51 (1.00) RAD51KDM4EUSP2ALDH1A1LTA
SCHEMBL29627175 0.84 RAD51 (1.00) RAD51KDM4EUSP2ALDH1A1LTA
SCHEMBL2415107 0.84 RAD51 (1.00) RAD51KDM4EUSP2ALDH1A1LTA
SCHEMBL29350628 0.83 P2RY6 (1.00) RAD51KDM4EUSP2ALDH1A1LTA
SCHEMBL29351286 0.83 P2RY6 (1.00) RAD51KDM4EUSP2ALDH1A1LTA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4746852-A1 LIPID AGGREGATES FOR INTRAARTICULAR ADMINISTRATION Universität Bern (CH) 2026-05-27 EP disclosed
EP-4729067-A2 ELECTRODE ASSEMBLY FOR APPLYING TUMOR TREATING FIELDS WITH A SHEET OF ANISOTROPIC MATERIAL Novocure GmbH (CH) 2026-04-22 EP disclosed
EP-4061961-B1 METHOD FOR DOUBLE STRAND SEQUENCING OXFORD NANOPORE TECH PLC (GB) 2026-04-08 EP disclosed
US-12584170-B2 Method of nanopore sequencing of concatenated nucleic acids OXFORD NANOPORE TECHNOLOGIES PLC (GB) 2026-03-24 US disclosed
EP-4709742-A1 MODIFIED HELICASES Oxford Nanopore Technologies PLC (GB) 2026-03-18 EP disclosed
US-20260072008-A1 METHOD OF CHARACTERISING A PEPTIDE, POLYPEPTIDE OR PROTEIN USING A NANOPORE UNIV OXFORD INNOVATION LTD (GB) 2026-03-12 US disclosed
US-20260072009-A1 METHOD OF CHARACTERISING A TARGET POLYPEPTIDE USING A NANOPORE OXFORD NANOPORE TECHNOLOGIES PLC (GB) 2026-03-12 US disclosed
US-20260063618-A1 METHOD OF CHARACTERISING A TARGET POLYPEPTIDE USING A NANOPORE Oxford Nanopore Technolgies PLC (GB) 2026-03-05 US disclosed
EP-4695612-A1 NOVEL PORE MONOMERS AND PORES Oxford Nanopore Technologies PLC (GB) 2026-02-18 EP disclosed
EP-4270008-B1 METHOD OF CHARACTERISING A TARGET POLYPEPTIDE USING A NANOPORE OXFORD NANOPORE TECH PLC (GB) 2026-02-04 EP disclosed
US-20220389481-A1 METHOD FOR DOUBLE STRAND SEQUENCING OXFORD NANOPORE TECHNOLOGIES PLC (GB) 2022-12-08 US disclosed
WO-2022234018-A1 METHOD FOR MODELING CYCLIC 3D EPITOPES TO BE USED IN THE DEVELOPMENT OF VACCINES SYNTHETIC VACCINES LTD (GB) 2022-11-10 WO disclosed
EP-4070092-A1 METHOD OF CHARACTERISING A TARGET POLYPEPTIDE USING A NANOPORE Oxford Nanopore Technologies PLC (GB) 2022-10-12 EP disclosed
EP-4070093-A1 METHOD Oxford Nanopore Technologies PLC (GB) 2022-10-12 EP disclosed
US-11459606-B2 Adaptors for nucleic acid constructs in transmembrane sequencing OXFORD NANOPORE TECHNOLOGIES PLC (GB) 2022-10-04 US disclosed
EP-4061961-A1 METHOD FOR DOUBLE STRAND SEQUENCING Oxford Nanopore Technologies PLC (GB) 2022-09-28 EP disclosed
CN-115004030-A Method 牛津纳米孔科技公开有限公司 2022-09-02 CN disclosed
US-20220177937-A1 POLYNUCLEOTIDE SYNTHESIS METHOD, KIT AND SYSTEM OXFORD NANOPORE TECHNOLOGIES LIMITED (GB) 2022-06-09 US disclosed
US-11352664-B2 Adaptors for nucleic acid constructs in transmembrane sequencing OXFORD NANOPORE TECHNOLOGIES PLC (GB) 2022-06-07 US disclosed
US-20220090192-A1 METHOD OF NANOPORE SEQUENCING OF CONCATENATED NUCLEIC ACIDS OXFORD NANOPORE TECHNOLOGIES LTD. (GB) 2022-03-24 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 (6 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-20260072008-A1 METHOD OF CHARACTERISING A PEPTIDE, POLYPEPTIDE OR PROTEIN USING A NANOPORE MAX, NPPA, NUP210 P2RY6 2219/4885CA1 3531/4885CA2 2469/4885
US-11352664-B2 Adaptors for nucleic acid constructs in transmembrane sequencing MTREX, PHAX, TARBP1 P2RY6 1477/4885CA1 4649/4885CA2 4395/4885
US-11459606-B2 Adaptors for nucleic acid constructs in transmembrane sequencing MTREX, PHAX, TARBP1 P2RY6 1477/4885CA1 4649/4885CA2 4395/4885
US-20260063618-A1 METHOD OF CHARACTERISING A TARGET POLYPEPTIDE USING A NANOPORE NUP210, NPPA, NUP160 P2RY6 2592/4885CA1 3649/4885CA2 3498/4885
US-20260072009-A1 METHOD OF CHARACTERISING A TARGET POLYPEPTIDE USING A NANOPORE NUP210, SLC9A2, SLC9A3 P2RY6 2684/4885CA1 2998/4885CA2 1602/4885
US-12584170-B2 Method of nanopore sequencing of concatenated nucleic acids POLN, NCL, PCNA P2RY6 1192/4885CA1 4877/4885CA2 4499/4885

“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.