SCHEMBL27676

SCHEMBL27676

CC(CN=C=O)CC(C)(C)CCN=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
SCHEMBL18533564 1.00
SCHEMBL22830372 0.95
SCHEMBL6700647 0.93
SCHEMBL3490118 0.93
SCHEMBL11311478 0.93
SCHEMBL3978532 0.90 TRPA1 (0.34)
SCHEMBL22585401 0.89
SCHEMBL627532 0.88
Octane SCHEMBL4304211 0.87
SCHEMBL7029626 0.87 ALDH1A1 (0.33)

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 20315 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12637630-B1 Metallized hydroxyl terminated, epoxidized polybutadiene solid fuel ramjet fuel McDonald, Brian A. (US) 2026-05-26 US claimed
CN-121471864-B Ultraviolet light curing adhesive composition for bonding optical composite film and preparation method thereof 上海绘兰材料科技有限公司 2026-05-15 CN claimed
EP-4739721-A1 A SOLVENT-FREE POLYURETHANE DISPERSION BASED ON POLYTRIMETHYLENE ETHER GLYCOL Covestro Deutschland AG (DE) 2026-05-13 EP claimed
US-12624246-B2 Curable film-forming compositions and coated structures with improved corrosion resistance and durability PPG INDUSTRIES OHIO, INC. (US) 2026-05-12 US claimed
US-12605306-B2 Method of manufacturing monomer composition, raw material composition, monomer composition, curable composition, and molded body MITSUI CHEMICALS, INC. (JP) 2026-04-21 US claimed
EP-4720199-A1 SELF-CROSSLINKABLE URETHANE (METH)ACRYLATES ARKEMA France (FR) 2026-04-08 EP claimed
US-12570864-B2 Storage-stable pigmented formulations containing isocyanate groups and use thereof COVESTRO DEUTSCHLAND AG (DE) 2026-03-10 US claimed
WO-2026040069-A1 REACTIVE HOT-MELT ADHESIVE COMPOSITION AND USE THEREOF HENKEL AG & CO. KGAA (DE) 2026-02-26 WO claimed
EP-4340807-B1 HAIR COLOR COMPOSITIONS FOR MITIGATING COLOR LOSS LUBRIZOL ADVANCED MAT INC (US) 2026-01-28 EP claimed
US-12516191-B2 Isocyanurate-containing polyisocyanate composition with stable chromaticity, and preparation method thereof WANHUA CHEMICAL GROUP CO., LTD. (CN) 2026-01-06 US claimed
EP-0065661-B1 SURFACE-ACTIVE AZO COMPOUNDS AND THEIR USE BAYER AG (DE) 1985-06-05 EP claimed
US-4507444-A BLEND METHACRYLIC ACID ESTERS AND POLYURETHANE ELASTOMERS BAYER AKTIENGESELLSCHAFT (DE) 1985-03-26 US claimed
US-4476053-A Surface-active azo compounds BAYER AKTIENGESELLSCHAFT (DE) 1984-10-09 US claimed
US-4456718-A CONTAINING POLYOXYALKYL GROUPS SCHERING AKTIENGESELLSCHAFT (DE) 1984-06-26 US claimed
EP-0025992-B1 PROCESS FOR COATING GLASS SURFACES CHEMISCHE WERKE HÜLS AG (DE) 1983-09-07 EP claimed
US-4375967-A Dental composition containing X-ray opaque material KULZER & CO. GMBH (DE) 1983-03-08 US claimed
EP-0065661-A2 Surface-active azo compounds and their use BAYER AG (DE) 1982-12-01 EP claimed
US-4302351-A ALIPHATIC OR CYCLOALIPHATIC, E-CAPROLACTAM CHEMISCHE WERKE HULS AKTIENGESELLSCHAFT (DE) 1981-11-24 US claimed
US-4191819-A Activated anionic polymerization of lactam with partially masked polyisocyanate BAYER AKTIENGESELLSCHAFT (DE) 1980-03-04 US claimed
US-4052943-A REACTION PRODUCT OF POLYGLYCOL ADIPATE AND A DIISOCYANATE THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 1977-10-11 US claimed