SCHEMBL444570

SCHEMBL444570

NCCc1ccc[nH]1

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
Bicarbonate SCHEMBL15062777 0.89 TSHR (0.39)
SCHEMBL4535567 0.86
SCHEMBL4623787 0.84 HRH3 (0.47)
SCHEMBL7172295 0.84 MAOA (0.42)
SCHEMBL5251062 0.82 HRH1 (0.48)
SCHEMBL30877273 0.80
SCHEMBL1697090 0.79
SCHEMBL7003873 0.79 GPR84 (0.41)
SCHEMBL79201 0.78 MAOA (0.47)
SCHEMBL25422764 0.77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240092780-A1 ADDUCTS AND DIMER COMPOUNDS SYNTHESIZED USING GK METHOD ANKH LIFE SCIENCES LIMITED (IE) 2024-03-21 US claimed
WO-2024050395-A1 ADDUCTS AND DIMER COMPOUNDS SYNTHESIZED USING GK METHOD ANKH LIFE SCIENCES LIMITED (IE) 2024-03-07 WO claimed
US-12358399-B2 Monitoring health of heat transfer fluids for electric systems ExxonMobil Technology and Engineering Company (US) 2025-07-15 US disclosed
CN-115605374-B Condition monitoring of heat transfer fluid for electrical systems 埃克森美孚技术与工程公司 2024-12-17 CN disclosed
US-12145913-B2 Inhibition of Olig2 activity Curtana Pharmaceuticals, Inc. (US) 2024-11-19 US disclosed
EP-4415561-A2 ORGANIC COMPOUNDS Givaudan SA (CH) 2024-08-21 EP disclosed
US-20240092780-A1 ADDUCTS AND DIMER COMPOUNDS SYNTHESIZED USING GK METHOD ANKH LIFE SCIENCES LIMITED (IE) 2024-03-21 US disclosed
CN-117106007-B Loose lupeane derivative and application thereof in preparation of multi-target tumor angiogenesis and invasion metastasis inhibitor 吉林农业大学 2024-03-19 CN disclosed
WO-2024050395-A1 ADDUCTS AND DIMER COMPOUNDS SYNTHESIZED USING GK METHOD ANKH LIFE SCIENCES LIMITED (IE) 2024-03-07 WO disclosed
CN-117106007-A Loose lupeane derivative and application thereof in preparation of multi-target tumor angiogenesis and invasion metastasis inhibitor 吉林农业大学 2023-11-24 CN disclosed
US-20230166635-A1 MONITORING HEALTH OF HEAT TRANSFER FLUIDS FOR ELECTRIC SYSTEMS ExxonMobil Technology and Engineering Company (US) 2023-06-01 US disclosed
WO-1993006198-A1 OIL COMPOSITIONS THE LUBRIZOL CORPORATION (US) 1993-04-01 WO disclosed
EP-0338989-B1 HETEROTETRACYCLIC LACTAM DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM CIBA-GEIGY AG (CH) 1993-03-17 EP disclosed
US-4997832-A Learning enhancement CIBA-GEIGY CORPORATION (US) 1991-03-05 US disclosed
EP-0172692-B1 HEXAHYDROINDOLIZINE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS AND METHODS AND INTERMEDIATES McNeilab, Inc. (US) 1990-04-18 EP disclosed
US-4897399-A ALZHEIMER'S, NOOTROPIC AGENTS CIBA-GEIGY CORP. (US) 1990-01-30 US disclosed
EP-0338989-A1 Heterotetracyclic lactam derivatives, process for their preparation, and pharmaceutical compositions containing them CIBA-GEIGY AG (CH) 1989-10-25 EP disclosed
US-4788203-A INHIBITING CALCIUM INDUCED CONTRACTION; USED IN CHEMOTHERAPHY TREATMENT MERCK & CO., INC. (US) 1988-11-29 US disclosed
EP-0172692-A1 Hexahydroindolizine compounds, pharmaceutical compositions and methods and intermediates McNeilab, Inc. (US) 1986-02-26 EP disclosed
US-4572911-A ANTISECRETORY AND ANTIDEPRESSANT AGENTS MCNEILAB, INC. (US) 1986-02-25 US disclosed