SCHEMBL454523

SCHEMBL454523

Nc1cc(N)c(N)c(N)n1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
NQO1 P15559 1/20 0.36
NOS3 P29474 3/20 0.35
NOS2 P35228 3/20 0.35
NOS1 P29475 2/20 0.35
CYP3A4 P08684 1/20 0.32
BLM P54132 1/20 0.32
PTK2 Q05397 1/20 0.32

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
Sulfuric Acid SCHEMBL9511477 0.86 ALDH1A1 (0.35) MAPTTDP1CYP3A4BLM
SCHEMBL18585819 0.72 MAPT (0.43) MAPTTDP1NQO1NOS3NOS2
SCHEMBL9511107 0.72 NOS2 (0.42) NOS3NOS2NOS1
SCHEMBL13514619 0.72 BACE1 (0.35) MAPTTDP1NOS3NOS2NOS1
SCHEMBL3367926 0.72 NQO1 (0.33) MAPTNQO1
SCHEMBL4395175 0.72 MAPT (0.37) MAPTTDP1NQO1NOS3NOS2
SCHEMBL17595014 0.72 ALDH1A1 (0.43) MAPTTDP1NQO1NOS3NOS2
SCHEMBL2955353 0.72 TDP1 (0.43) MAPTTDP1NOS3NOS2NOS1
SCHEMBL3808172 0.72 KDM4E (0.43) TDP1NQO1NOS3NOS2NOS1
SCHEMBL5705216 0.72 MAPT (0.32) MAPTTDP1NOS3NOS2NOS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250066570-A1 LAMINATE DEVICE WITH METALLIC AND POLYMER LAYERS QUANTUM MICROMATERIALS INC (US) 2025-02-27 US claimed
US-20230357578-A1 AIRTIGHT FILM WITH CERAMIC SEALING LAYER AND POLYMER SEALING LAYER Quantum MicroMaterials, Inc. 2023-11-09 US claimed
WO-2021150018-A1 SURFACE MODIFIED SUBSTRATE WITH AMINO UNSATURATED HETEROCYCLIC COMPOUND AND SURFACE MODIFYING METHOD THEREOF 하이드로메이트 코팅스, 인크. 2021-07-29 WO claimed
EP-1438318-A1 TISSUE SPECIFIC FLUORESCENT CHELATES Texas Tech University (US) 2004-07-21 EP claimed
WO-2003035655-A1 TISSUE SPECIFIC FLUORESCENT CHELATES TEXAS TECH UNIVERSITY (US) 2003-05-01 WO claimed
EP-1103248-B1 Hair dyeing composition comprising N-ethyl-N-isopropyl-p-phenylenediamine GOLDWELL GMBH (DE) 2001-08-22 EP claimed
US-6093219-A Composition for the oxidation dyeing of keratin fibers, comprising at least two oxidation bases and an indole coupler, and dyeing process L'OREAL (FR) 2000-07-25 US claimed
US-4904275-A OXIDIZER L'OREAL (FR) 1990-02-27 US claimed
EP-0039030-B1 COUPLER COMPONENTS FOR OXIDATIVE HAIR DYES, THEIR PREPARATION AND THEIR USE, AND HAIR DYEING COMPOSITIONS CONTAINING THEM Henkel Kommanditgesellschaft auf Aktien (DE) 1984-07-18 EP claimed
JP-2188584-A None JP disclosed
JP-2174710-A None JP disclosed
US-20250066570-A1 LAMINATE DEVICE WITH METALLIC AND POLYMER LAYERS QUANTUM MICROMATERIALS INC (US) 2025-02-27 US disclosed
US-12077646-B2 Coating substrate by polymerization of amine compound and apparatus having polymer coated substrate Quantum MicroMaterials, Inc. (US) 2024-09-03 US disclosed
US-20240209231-A1 AIRTIGHT FILM WITH CERAMIC SEALING LAYER AND POLYMER SEALING LAYER Quantum MicroMaterials, Inc. 2024-06-27 US disclosed
EP-0566698-A1 AMINO-SUBSTITUTED PYRIMIDINES, DERIVATIVES AND METHODS OF USE THEREFOR THE ROCKEFELLER UNIVERSITY (US) 1993-10-27 EP disclosed
WO-1992011853-A1 AMINO-SUBSTITUTED PYRIMIDINES, DERIVATIVES AND METHODS OF USE THEREFOR THE ROCKEFELLER UNIVERSITY (US) 1992-07-23 WO disclosed
JP-H02188584-A NOVEL HETEROCYCLIC COMPOUND, PRODUCTION THEREOF AND PIGMENT-DYE COMPOSITION CONTAINING THE SAME KAO CORP 1990-07-24 JP disclosed
JP-H02174710-A DYEING COMPOSITION OF KERATIN FIBER KAO CORP 1990-07-06 JP disclosed
EP-0358853-A2 Stabilizing particulate additives compounds for hydrogen peroxyde and use thereof Henkel Kommanditgesellschaft auf Aktien (DE) 1990-03-21 EP disclosed
US-4904275-A OXIDIZER L'OREAL (FR) 1990-02-27 US disclosed