SCHEMBL94111

SCHEMBL94111

Cc1cc(C)nc(N)c1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL31324837 1.00 — —
Bromide SCHEMBL5755666 0.97 NOS2 (0.95) —
SCHEMBL105871 0.85 — —
Trifluoroacetic Acid SCHEMBL1846801 0.80 NOS2 (0.64) —
SCHEMBL7489 0.78 — —
SCHEMBL9472907 0.78 NOS3 (0.63) —
SCHEMBL1050198 0.78 NOS3 (0.63) —
SCHEMBL10399561 0.78 — —
Iodide SCHEMBL20816339 0.76 NOS3 (0.60) —
Bromide SCHEMBL10623440 0.76 NOS3 (0.60) —

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 1545 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240423887-A1 COMPOSITION COMPRISING A DYE AND INORGANIC ALKALIZING AGENT KAO CORPORATION (JP) 2024-12-26 — — US claimed
EP-4408376-A1 COMPOSITION COMPRISING A DYE AND INORGANIC ALKALIZING AGENT Kao Corporation (JP) 2024-08-07 — — EP claimed
CN-118043022-A Composition comprising a dye and an inorganic alkalizing agent 花王株式会社 2024-05-14 — — CN claimed
CN-111303047-B Synthesis method of 2-amino-4, 6-lutidine 上海阿拉丁生化科技股份有限公司 2023-04-25 — — CN claimed
WO-2023054558-A1 COMPOSITION COMPRISING A DYE AND INORGANIC ALKALIZING AGENT KAO CORPORATION (JP) 2023-04-06 — — WO claimed
EP-4159184-A1 COMPOSITION COMPRISING A DYE AND INORGANIC ALKALIZING AGENT Kao Corporation (JP) 2023-04-05 — — EP claimed
CN-113771153-B Preparation method of plywood for bakelite box 安捷包装(苏州)股份有限公司 2022-11-15 — — CN claimed
CN-115210339-A Etching solution for titanium nitride and molybdenum conductive metal wires 弗萨姆材料美国有限责任公司 2022-10-18 — — CN claimed
CN-112979542-B Pyridine derivative and preparation method thereof 北京理工大学 2022-08-19 — — CN claimed
CN-113771153-A Preparation method of plywood for bakelite box 安捷包装(苏州)股份有限公司 2021-12-10 — — CN claimed
WO-2003044018-A1 1H-PYRROLO[3,2-B]PYRIDINE-3-CARBOXYLIC ACID AMIDES NEUROGEN CORPORATION (US) 2003-05-30 — — WO claimed
EP-1297818-A2 Hair dye KPSS-Kao Professional Salon Services GmbH (DE) 2003-04-02 — — EP claimed
EP-1250912-A1 Hair dye composition GOLDWELL GmbH (DE) 2002-10-23 — — EP claimed
US-6384278-B1 REACTING AN AROMATIC AMINE AND AN ALKANOIC ACID OR ESTER IN THE PRESENCE OF A BORON COMPOUND AND OPTIONALLY, A CHELATING AGENT TO PRODUCE AN AROMATIC CARBOXAMIDE SUCH AS 8(5-CHLORO-2 -HYDROXYANILINO)-8-OXOOCTANOIC ACID EMISPHERE TECHNOLOGIES, INC. 2002-05-07 — — US claimed
EP-0667562-B1 Charge injection barrier for positive charging organic photoconductor HEWLETT PACKARD CO (US) 2001-03-21 — — EP claimed
CN-1218402-A Increasing implantation rate after in vitro fertilization SCHERING AG (DE) 1999-06-02 — — CN claimed
EP-0500616-B1 OLIGOMERIC TO POLYMERIC CHARACTER COMPLEXES ATOTECH DEUTSCHLAND GMBH (DE) 1998-01-07 — — EP claimed
US-5503877-A ORGANONITROGEN, ORGANOMETALLIC POLYMERS OR OLIGOMERS;REDUCTION ATOTECH DEUTSCHALND GMBH (DE) 1996-04-02 — — US claimed
US-4812572-A DIAZOTIZATION IN HYDROGEN FLUORIDE, DECOMPOSITION UNDER PRESSURE IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1989-03-14 — — US claimed
EP-0196743-A2 Stable chemical compositions containing chromogenic materials and peroxides, and method for obtaining them SAVYON DIAGNOSTICS LTD. (IL) 1986-10-08 — — EP claimed
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