SCHEMBL585408

SCHEMBL585408

[Li]c1cccc(C)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
Boric Acid SCHEMBL27660800 0.90 ACHE (0.50)
Boric Acid SCHEMBL28167958 0.90 ACHE (0.50)
Biphenyl SCHEMBL27711923 0.88 ACHE (0.48)
M-Xylene SCHEMBL6397624 0.77
M-Xylene SCHEMBL891494 0.77 ACHE (1.00)
M-Xylene SCHEMBL28189 0.77
SCHEMBL2158778 0.77
M-Xylene SCHEMBL78260 0.74 ACHE (0.92)
M-Xylene SCHEMBL18890231 0.74 ACHE (0.92)
M-Xylene SCHEMBL358508 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119912483-A Preparation method and equipment of phenyl organosiloxane compound 洛阳中硅高科技有限公司 2025-05-02 CN claimed
US-12522622-B1 Synthesis of novel vanadium alkylidyne complexes and their use in metathesis reactions THE FLORIDA INTERNATIONAL UNIVERSITY BOARD OF TRUSTEES (US) 2026-01-13 US disclosed
CN-119912483-A Preparation method and equipment of phenyl organosiloxane compound 洛阳中硅高科技有限公司 2025-05-02 CN disclosed
US-20240376288-A1 Crosslinked Rubber Composition, and Method for Producing Crosslinked Rubber Composition JAPAN ELASTOMER CO., LTD. (JP) 2024-11-14 US disclosed
CN-113845634-B Briquette molding of rubber composition, method for producing the same, rubber composition for crosslinking, and tread for tire 旭化成株式会社 2024-07-26 CN disclosed
EP-4403603-A1 CROSSLINKED RUBBER COMPOSITION, METHOD FOR PRODUCING CROSSLINKED RUBBER COMPOSITION Japan Elastomer Co., Ltd. (JP) 2024-07-24 EP disclosed
CN-117836362-A Crosslinked rubber composition and method for producing crosslinked rubber composition 日本弹性体株式会社 2024-04-05 CN disclosed
US-11905357-B2 Molded bale of rubber composition, method for producing molded bale of rubber composition, crosslinking rubber composition, and tread for tire ASAHI KASEI KABUSHIKI KAISHA (JP) 2024-02-20 US disclosed
WO-2023038095-A1 CROSSLINKED RUBBER COMPOSITION, METHOD FOR PRODUCING CROSSLINKED RUBBER COMPOSITION 日本エラストマー株式会社 2023-03-16 WO disclosed
EP-3587490-B1 METHACRYLIC RESIN COMPOSITION AND USE THEREOF KURARAY CO (JP) 2022-10-12 EP disclosed
US-5545759-A Method of producing tris(pentafluorophenyl)borane using pentafluorophenyl alkali metal salt prepared from pentafluorobenzene TOSOH AKZO CORPORATION (JP) 1996-08-13 US disclosed
US-5493056-A Method of producing tetrakis (pentafluorophenyl) borate derivatives using pentafluorophenyl alkali metal salt prepared from pentafluorobenzene TOSOH AKZO CORPORATION (JP) 1996-02-20 US disclosed
US-5387727-A Method of producing pentafluorophenyl alkali metal salt using pentafluorobenzene in a chain ether type solvent TOSOH AKZO CORPORATION (JP) 1995-02-07 US disclosed
EP-0608563-A2 Method of producing tetrakis(pentafluorophenyl)borate derivatives using pentafluorophenyl alkali metal salt prepared from pentafluorobenzene TOSOH AKZO CORPORATION (JP) 1994-08-03 EP disclosed
EP-0604962-A1 Method of producing tris(pentafluorophenyl)borane using pentafluorophenyl alkyli metal salt prepared from pentafluorobenzene TOSOH AKZO CORPORATION (JP) 1994-07-06 EP disclosed
EP-0604960-A2 Method of producing pentafluorophenyl alkali metal salt using pentafluorobenzene in an open chain ether type solvent TOSOH AKZO CORPORATION (JP) 1994-07-06 EP disclosed
EP-0024943-B1 5,6,7-TRINOR-4,8-INTER-M-PHENYLENE PGI2 DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM TORAY INDUSTRIES, INC. (JP) 1983-08-17 EP disclosed
US-4301164-A FOR USE AS ANTIULCER AGENTS, HYPOTENSIVE AGENTS, ANTITHROMBOSIC AGENTS TORAY INDUSTRIES, INC. (JP) 1981-11-17 US disclosed
EP-0024943-A1 5,6,7-Trinor-4,8-inter-m-phenylene PGI2 derivatives and pharmaceutical compositions containing them TORAY INDUSTRIES, INC. (JP) 1981-03-11 EP disclosed
US-3932477-A COORDINATION CATALYSTS, OXYGEN SCAVENGERS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1976-01-13 US disclosed