Toluene

Toluene

SCHEMBL578212

Cc1ccccc1.[CH2]C

nearest known ligand 0.00

Full drug profile on Sugi Atlas →

⚠ 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
Toluene SCHEMBL8943621 0.92 ACHE (0.85)
Toluene SCHEMBL4669662 0.92
Toluene SCHEMBL11235816 0.92 ACHE (0.85)
Toluene SCHEMBL3396447 0.92 ACHE (0.85)
Toluene SCHEMBL175861 0.92 ACHE (1.00)
SCHEMBL12344943 0.92 ACHE (1.00)
Toluene SCHEMBL4429042 0.92 ACHE (1.00)
Toluene SCHEMBL8824270 0.92 ACHE (1.00)
Toluene SCHEMBL1 0.92
SCHEMBL12344964 0.92 ACHE (1.00)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11987555-B2 Malassezin and analogs thereof as skin brightening agents VERSICOLOR TECHNOLOGIES, LLC (US) 2024-05-21 US disclosed
US-20230022475-A1 METHOD OF INCREASING RESISTANCE AGAINST SOYBEAN RUST IN TRANSGENIC PLANTS BY INCREASING THE SCOPARONE BASF PLANT SCIENCE COMPANY GMBH (DE) 2023-01-26 US disclosed
US-11220491-B2 Photoprotective compositions containing Malassezia-derived compounds and/or chemical analogs thereof VERSICOLOR TECHNOLOGIES, LLC (US) 2022-01-11 US disclosed
US-20210380532-A1 MALASSEZIN AND ANALOGS THEREOF AS SKIN BRIGHTENING AGENTS VERSICOLOR TECHNOLOGIES, LLC 2021-12-09 US disclosed
EP-3774811-A1 PHOTOPROTECTIVE COMPOSITIONS CONTAINING MALASSEZIA-DERIVED COMPOUNDS AND/OR CHEMICAL ANALOGS THEREOF Einziger, Michael (US) 2021-02-17 EP disclosed
EP-3686222-A1 POLYMERIZABLE COMPOUND, POLYMERIZABLE COMPOSITION, POLYMER, AND OPTICALLY ANISOTROPIC SUBSTANCE Zeon Corporation (JP) 2020-07-29 EP disclosed
WO-2020120753-A1 METHOD OF INCREASING RESISTANCE AGAINST SOYBEAN RUST IN TRANSGENIC PLANTS BY IN-CREASING THE SCOPARONE CONTENT BASF PLANT SCIENCE COMPANY GMBH (DE) 2020-06-18 WO disclosed
EP-3330300-B1 POLYMERIZABLE COMPOUND, POLYMERIZABLE COMPOSITION, POLYMER, AND OPTICALLY ANISOTROPIC SUBSTANCE ZEON CORP (JP) 2020-04-01 EP disclosed
US-20190345140-A1 PHOTOPROTECTIVE COMPOSITIONS CONTAINING MALASSEZIA-DERIVED COMPOUNDS AND/OR CHEMICAL ANALOGS THEREOF VERSICOLOR TECHNOLOGIES, LLC 2019-11-14 US disclosed
WO-2019200232-A1 PHOTOPROTECTIVE COMPOSITIONS CONTAINING MALASSEZIA-DERIVED COMPOUNDS AND/OR CHEMICAL ANALOGS THEREOF EINZIGER MICHAEL (US) 2019-10-17 WO disclosed
US-4965258-A Anticoagulant; thromboxane a2 antagonist BAYER AKTIENGESELLSCHAFT (DE) 1990-10-23 US disclosed
EP-0201221-B1 6-(1-ACYL-1-HYDROXY METHYL) PENICILLANIC ACID DERIVATIVES PFIZER INC. (US) 1990-08-01 EP disclosed
US-4904797-A REACTING A (BENZENESULFONAMIDOALKYL)CYCLOALKANO(1,2-B)INDOLE WITH ACRYLONITRILE; HYDROLYSIS, HYDROGENATION, REDUCTION BAYER AKTIENGESELLSCHAFT (DE) 1990-02-27 US disclosed
US-4827032-A INTERMEDIATES FOR ANTICOAGULANTS BAYER AKTIENGESELLSCHAFT (DE) 1989-05-02 US disclosed
US-4801726-A HYDRAZIDE SILICAS NORTHEASTERN UNIVERSITY (US) 1989-01-31 US disclosed
EP-0290145-A1 Aliphatic carboxamides ZENECA INC. (US) 1988-11-09 EP disclosed
US-4758645-A Preparation of graft copolymer and paint use thereof NIPPON PAINT CO., LTD. (JP) 1988-07-19 US disclosed
US-4714634-A POLYMER BASED ON THE ESTER-INTERCHANGE REACTION PRODUCT OF A CELLULOSE ESTER AND A MONO- OR DIMALEATE AND AN UNSATURATED COMPOUND NIPPON PAINT CO., LTD. (JP) 1987-12-22 US disclosed
EP-0204344-A2 Sialosylcerebrosides and a preparation method thereof RIKAGAKU KENKYUSHO (JP) 1986-12-10 EP disclosed
US-4444867-A DYE DIFFUSION TRANSFER AGFA-GEVAERT AKTIENGESELLSCHAFT (DE) 1984-04-24 US disclosed