SCHEMBL54555

SCHEMBL54555

CC(CCCCC(C)(C)N=C=O)N=C=O

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
SCHEMBL14118745 0.98
SCHEMBL5462873 0.95
SCHEMBL28253208 0.95
SCHEMBL28831735 0.92
SCHEMBL5201501 0.89
SCHEMBL28364515 0.88
SCHEMBL29085131 0.88
O-Xylene SCHEMBL888078 0.87
1,6-Hexanediol SCHEMBL9720610 0.87
SCHEMBL14118699 0.87

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

Appears in 22943 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119752381-B Bi-component sealant and preparation method and application thereof CYBRID TECHNOLOGIES INC. (CN) 2026-05-26 CN claimed
CN-119859238-B Bio-based chain extender and application thereof NINGBO INSTITUTE OF MATERIALS TECHNOLOGY & ENGINEERING, CHINESE ACADEMY OF SCIENCES (CN) 2026-05-26 CN claimed
CN-116218004-B Janus structure program temperature control elastic material and preparation method and application thereof SUZHOU INSTITUTE OF NANO-TECH AND NANO-BIONICS (SINANO), CHINESE ACADEMY OF SCIENCES (CN) 2026-05-26 CN claimed
CN-122075537-A Application of graphene- (RADA-IKVAV) -pranoprofen, eye drops and preparation method 2026-05-26 CN claimed
WO-2026105037-A1 ANTIMICROBIAL MICROFIBERS FROM ELECTROSPINNING POLAROID THERAPEUTICS AG (CH) 2026-05-21 WO claimed
EP-4745119-A1 ISOCYANATE COMPOSITION Hanwha Solutions Corporation (KR) 2026-05-20 EP claimed
CN-122059610-A Stain-resistant matte glaze composition and ceramic product 福建省德化县晖盛陶瓷有限公司 2026-05-19 CN claimed
CN-122037749-A Pipeline protective coating and preparation method thereof 青岛爱尔家佳新材料股份有限公司 2026-05-15 CN claimed
CN-122010802-A Optical monomer, holographic recording medium, preparation method and related device 珠海莫界科技有限公司 2026-05-12 CN claimed
EP-4737527-A2 SINGLE COMPONENT UV CURABLE CONFORMAL COATING WITH MOISTURE SECONDARY CURE FUNCTION H. K. Wentworth Limited (GB) 2026-05-06 EP claimed
US-4106932-A PRESSURE-RUPTURABLE MICROCAPSULES, FATTY ACID ESTER CORE, POLYUREA SHELL H. L. BLACHFORD LIMITED (CA) 1978-08-15 US claimed
US-4104265-A DIENE PREPOLYMERS, ISOCYANAATES COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) 1978-08-01 US claimed
US-4096129-A Glutarate-containing polyesterpolyols, methods of preparation and polyurethane compositions derived therefrom FABRIDYNE, INC. (US) 1978-06-20 US claimed
US-4072702-A IMPROVES MECHANICAL PROPERTIES THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) 1978-02-07 US claimed
US-4071313-A TREATMENT OF FIBERS COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANIZATION (AU) 1978-01-31 US claimed
US-4040991-A FOR RETICULATED, PARTIALLY HYDROLYZED POLYESTERURETHANE COPOLYMERS IN FUEL TANKS; ADDING A DIISOCYANATE OR EPOXY COMPOUND MCDONNELL DOUGLAS CORPORATION (US) 1977-08-09 US claimed
US-4024317-A Process for coating pretreated vulcanized articles of saturated or unsaturated polyolefin rubber CHEMISCHE WERKE HULS AKTIENGESELLSCHAFT (DT) 1977-05-17 US claimed
US-4003751-A CARBAMOYLOXYALKYL ACRYLATES UNION CARBIDE CORPORATION (US) 1977-01-18 US claimed
US-3950452-A Polyurethane high-voltage insulator appliance DR. BECK & CO. AG (DT) 1976-04-13 US claimed
US-3939126-A Acrylyl-terminated urea-urethane compositions UNION CARBIDE CORPORATION (US) 1976-02-17 US claimed