SCHEMBL50667

SCHEMBL50667

c1ccc2[s+]c3ccccc3nc2c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.56
ALDH1A1 P00352 7/20 0.46
HPGD P15428 4/20 0.46
GLA P06280 3/20 0.46
ACHE P22303 2/20 0.46
NQO2 P16083 5/20 0.43
KDM4E B2RXH2 4/20 0.40
HSD17B10 Q99714 3/20 0.40
POLB P06746 3/20 0.40
KMT2A Q03164 3/20 0.40
MAOA P21397 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
CASP1 P29466 2/20 0.40
CASP7 P55210 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
CHRM2 P08172 1/20 0.40
ADRA2A P08913 1/20 0.40
ADORA3 P0DMS8 1/20 0.40
CHRM1 P11229 1/20 0.40
DRD1 P21728 1/20 0.40

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
Hydrochloric Acid SCHEMBL740017 0.97 MAPT (0.53) MAPTALDH1A1HPGDGLAACHE
Iodide SCHEMBL1471059 0.97 MAPT (0.53) MAPTALDH1A1HPGDGLAACHE
Hydrochloric Acid SCHEMBL31542018 0.97 MAPT (0.53) MAPTALDH1A1HPGDGLAACHE
Water SCHEMBL1146714 0.95 MAPT (0.50) MAPTALDH1A1HPGDGLAACHE
Iodide SCHEMBL1146708 0.92 MAPT (0.48) MAPTALDH1A1HPGDGLAACHE
SCHEMBL3360974 0.86 MAPT (0.42) MAPTALDH1A1HPGDGLAACHE
SCHEMBL8987972 0.84 MAPT (0.40) MAPTALDH1A1HPGDGLAACHE
SCHEMBL12273001 0.81 HTR3A (0.48) MAPTALDH1A1HPGDGLAACHE
Iodide SCHEMBL12813166 0.79 HTR3A (0.47) MAPTALDH1A1HPGDGLAACHE
Trifluoroacetic Acid SCHEMBL2590381 0.78 ALDH1A1 (0.38) MAPTALDH1A1HPGDGLAACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170275572-A1 COMPOSITIONS FOR PHOTODYNAMIC CONTROL OF INFECTION PUREPURGE, INC. (US) 2017-09-28 US claimed
EP-3193864-A1 COMPOSITIONS FOR PHOTODYNAMIC CONTROL OF INFECTION Purepurge, Inc. (US) 2017-07-26 EP claimed
EP-3055291-A1 METHODS OF CHEMICAL SYNTHESIS OF DIAMINOPHENOTHIAZINIUM COMPOUNDS INCLUDING METHYLTHIONINIUM CHLORIDE (MTC) WisTa Laboratories Ltd. (SG) 2016-08-17 EP claimed
WO-2016039812-A1 COMPOSITIONS FOR PHOTODYNAMIC CONTROL OF INFECTION PUREPURGE, INC. (US) 2016-03-17 WO claimed
WO-2015052496-A1 METHODS OF CHEMICAL SYNTHESIS OF DIAMINOPHENOTHIAZINIUM COMPOUNDS INCLUDING METHYLTHIONINIUM CHLORIDE (MTC) WISTA LABORATORIES LTD. (SG) 2015-04-16 WO claimed
US-6966213-B2 Rapid method for detecting leaks of hydraulic fluids in production plants NALCO COMPANY (US) 2005-11-22 US claimed
US-20050160795-A1 Rapid method for detecting leaks of hydraulic fluids in production plants ECOLAB USA INC. 2005-07-28 US claimed
US-20010046662-A1 Method of inactivating pathogens in a red blood cell-containing composition THE AMERICAN NATIONAL RED CROSS 2001-11-29 US claimed
WO-2001078792-A1 METHOD OF INACTIVATING PATHOGENS THE AMERICAN NATIONAL RED CROSS (US) 2001-10-25 WO claimed
EP-0973383-A4 INTRACELLULAR AND EXTRACELLULAR DECONTAMINATION OF WHOLE BLOOD AND BLOOD COMPONENTS BY AMPHIPHILIC PHENOTHIAZIN-5-IUM DYES PLUS LIGHT AMERICAN NAT RED CROSS (US) 2001-08-22 EP claimed
WO-2001049328-A1 PHOTODYNAMIC INACTIVATION OF PATHOGENS IN BLOOD BY PHENOTHIAZINES AND OXYGEN THE AMERICAN NATIONAL RED CROSS (US) 2001-07-12 WO claimed
US-6030767-A ADDING DYE TO WHOLE BLOOD OR BLOOD COMPONENTS SUCH AS ERYTHROCYTES OR PLASMA, THEN IRRADIATING WITH LIGHT OF AN APPROPRIATE INTENSITY AND WAVELENGTH FOR A SUFFICIENT TIME; FOR DEACTIVATING VIRUSES, BACTERIA, PARASITES AND LEUKOCYTES THE AMERICAN NATIONAL RED CROSS (US) 2000-02-29 US claimed
EP-0973383-A1 INTRACELLULAR AND EXTRACELLULAR DECONTAMINATION OF WHOLE BLOOD AND BLOOD COMPONENTS BY AMPHIPHILIC PHENOTHIAZIN-5-IUM DYES PLUS LIGHT THE AMERICAN NATIONAL RED CROSS (US) 2000-01-26 EP claimed
WO-1998031219-A9 INTRACELLULAR AND EXTRACELLULAR DECONTAMINATION OF WHOLE BLOOD AND BLOOD COMPONENTS BY AMPHIPHILIC PHENOTHIAZIN-5-IUM DYES PLUS LIGHT 1998-12-17 WO claimed
WO-1998031219-A1 INTRACELLULAR AND EXTRACELLULAR DECONTAMINATION OF WHOLE BLOOD AND BLOOD COMPONENTS BY AMPHIPHILIC PHENOTHIAZIN-5-IUM DYES PLUS LIGHT THE AMERICAN NATIONAL RED CROSS (US) 1998-07-23 WO claimed
US-5545516-A LEUKODEPLETING TRANSFUSIBLE COMPOSITION, ADDING PHENOTHIAZINIUM DYE, IRRADIATING WITH LIGHT OF INTENSITY AND WAVELENGTHS TO BE ABSOBED BY DYE, INACTIVATING EXTRACELLULAR ENVELOPED VIRUSES PRESENT THE AMERICAN NATIONAL RED CROSS (US) 1996-08-13 US claimed
WO-1991016911-A1 DECONTAMINATION OF WHOLE BLOOD AND CELLULAR COMPONENTS BY PHENTHIAZIN-5-IUM-DYES PLUS LIGHT THE AMERICAN NATIONAL RED CROSS (US) 1991-11-14 WO claimed
US-20260048066-A1 TREATMENT OF NEURODEGENERATIVE DISORDERS UTILISING METHYLTHIONINIUM (MT)-CONTAINING COMPOUNDS WISTA LABORATORIES LTD (SG) 2026-02-19 US disclosed
WO-1991016911-A1 DECONTAMINATION OF WHOLE BLOOD AND CELLULAR COMPONENTS BY PHENTHIAZIN-5-IUM-DYES PLUS LIGHT THE AMERICAN NATIONAL RED CROSS (US) 1991-11-14 WO disclosed
WO-1991016911-A1 DECONTAMINATION OF WHOLE BLOOD AND CELLULAR COMPONENTS BY PHENTHIAZIN-5-IUM-DYES PLUS LIGHT THE AMERICAN NATIONAL RED CROSS (US) 1991-11-14 WO 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 (1 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-20260048066-A1 TREATMENT OF NEURODEGENERATIVE DISORDERS UTILISING METHYLTHIONINIUM (MT)-CONTAINING COMPOUNDS MAPT, PARK7, TARDBP MAPT 1/4885ALDH1A1 4715/4885HPGD 4355/4885

“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.