SCHEMBL12500

SCHEMBL12500

Cc1ccc(F)cc1C

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
SCHEMBL18867943 1.00 — —
SCHEMBL31633797 1.00 — —
SCHEMBL29212131 0.85 ALDH1A1 (0.41) —
SCHEMBL60954 0.79 — —
SCHEMBL29370717 0.79 — —
SCHEMBL30377758 0.79 NISCH (0.52) —
SCHEMBL14039912 0.79 PDE3B (0.44) —
SCHEMBL168684 0.79 — —
SCHEMBL29367748 0.79 — —
SCHEMBL9139591 0.79 NISCH (0.52) —

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 1434 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119219455-A Aromatic ring hydrogen-deuterium exchange reaction catalytic system and preparation method of deuterated aromatic hydrocarbon 国科大杭州高等研究院 2024-12-31 — — CN claimed
US-12027670-B2 Non-aqueous electrolyte solution and lithium secondary battery including the same LG ENERGY SOLUTION, LTD. (KR) 2024-07-02 — — US claimed
EP-3315579-B1 SURFACE TREATMENT AGENT INCLUDING PERFLUORO(POLY)ETHER GROUP-CONTAINING SILANE COMPOUND DAIKIN IND LTD (JP) 2024-05-01 — — EP claimed
US-11881558-B2 Electrolytes for lithium-containing battery cells APPLE INC. (US) 2024-01-23 — — US claimed
CN-111684643-B Nonaqueous electrolyte solution and lithium secondary battery comprising same 株式会社LG新能源 2023-07-07 — — CN claimed
US-20210218061-A1 ELECTROLYTES FOR LITHIUM-CONTAINING BATTERY CELLS APPLE INC. (US) 2021-07-15 — — US claimed
EP-3088487-B1 SURFACE TREATING AGENT INCLUDING PERFLUORO(POLY)ETHER-GROUP-CONTAINING SILANE COMPOUND DAIKIN IND LTD (JP) 2021-05-05 — — EP claimed
US-20210057780-A1 Non-Aqueous Electrolyte Solution and Lithium Secondary Battery Including the Same LG CHEM, LTD. (KR) 2021-02-25 — — US claimed
EP-3734738-A1 NONAQUEOUS ELECTROLYTE AND LITHIUM SECONDARY BATTERY COMPRISING SAME LG CHEM, LTD. (KR) 2020-11-04 — — EP claimed
US-10781222-B2 Surface treating agent including perfluoro(poly)ether-group-containing silane compound DAIKIN INDUSTRIES, LTD. (JP) 2020-09-22 — — US claimed
EP-3315579-A1 SURFACE TREATMENT AGENT INCLUDING PERFLUORO(POLY)ETHER GROUP-CONTAINING SILANE COMPOUND Daikin Industries, Ltd. (JP) 2018-05-02 — — EP claimed
US-20160340544-A1 SURFACE TREATING AGENT INCLUDING PERFLUORO(POLY)ETHER-GROUP-CONTAINING SILANE COMPOUND DAIKIN INDUSTRIES, LTD. (JP) 2016-11-24 — — US claimed
EP-3088487-A1 SURFACE TREATING AGENT INCLUDING PERFLUORO(POLY)ETHER-GROUP-CONTAINING SILANE COMPOUND Daikin Industries, Ltd. (JP) 2016-11-02 — — EP claimed
CN-105399632-A Synthetic method for 1,5-bis(chloromethyl)-3-fluorobenzene UNIV CHANGZHOU 2016-03-16 — — CN claimed
EP-2736112-A2 NONAQUEOUS ELECTROLYTE AND LITHIUM SECONDARY BATTERY USING SAME LG Chem, Ltd. (KR) 2014-05-28 — — EP claimed
US-20130252113-A1 NON-AQUEOUS ELECTROLYTE AND LITHIUM SECONDARY BATTERY USING THE SAME LG CHEM, LTD. (KR) 2013-09-26 — — US claimed
US-7575833-B2 Nonaqueous electrolyte and lithium secondary battery employing the same MITSUBISHI CHEMICAL CORPORATION (JP) 2009-08-18 — — US claimed
WO-2007069986-A1 NEW OXABISPIDINE COMPOUNDS FOR THE TREATMENT OF CARDIAC ARRHYTHMIAS ASTRAZENECA AB (SE) 2007-06-21 — — WO claimed
EP-1559704-A1 Synthesis of 4-substituted phthalaldehyde ETHICON, INC. (US) 2005-08-03 — — EP claimed
US-6891069-B1 Synthesis of 4-substituted phthalaldehyde ETHICON, INC. (US) 2005-05-10 — — US claimed
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