SCHEMBL104991

SCHEMBL104991

CC1(N=C=O)CCCCC1

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
SCHEMBL13952857 1.00
SCHEMBL14544269 1.00
SCHEMBL19322788 1.00
SCHEMBL21782567 1.00
SCHEMBL20665906 1.00
SCHEMBL10928090 0.97
SCHEMBL27476605 0.93
SCHEMBL28044253 0.93
SCHEMBL17771610 0.93
Acetic Acid SCHEMBL3815500 0.89 ALDH1A1 (0.35)

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 1097 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4662263-A1 POLYCAPROLACTONE POLYOLS, POLYURETHANES, AND METHODS OF MAKING AND USING THE SAME Ingevity UK Ltd (GB) 2025-12-17 EP claimed
US-20250243313-A1 POLYCAPROLACTONE POLYOLS, ELASTOMERS, AND METHODS OF MAKING AND USING THE SAME INGEVITY UK LTD (GB) 2025-07-31 US claimed
WO-2025149744-A1 POLYCAPROLACTONE POLYOLS, POLYURETHANE DISPERSIONS, AND METHODS OF MAKING AND USING THE SAME INGEVITY UK LTD (GB) 2025-07-17 WO claimed
US-20250230274-A1 POLYCAPROLACTONE POLYOLS, POLYURETHANE DISPERSIONS, AND METHODS OF MAKING AND USING THE SAME INGEVITY UK LTD (GB) 2025-07-17 US claimed
US-20240287363-A1 POLYCAPROLACTONE POLYOLS, POLYURETHANES, AND METHODS OF MAKING AND USING THE SAME INGEVITY UK LTD (GB) 2024-08-29 US claimed
WO-2024165215-A1 POLYCAPROLACTONE POLYOLS, POLYURETHANES, AND METHODS OF MAKING AND USING THE SAME INGEVITY UK, LTD. (GB) 2024-08-15 WO claimed
CN-118372539-A Oil-water separation composite material and preparation method and application thereof 武汉纺织大学 2024-07-23 CN claimed
EP-4396258-A1 BIO-BASED RESIN, CURABLE COMPOSITION AND POLYURETHANE BASED THEREON, AND RELATED METHODS Ingevity South Carolina, LLC (US) 2024-07-10 EP claimed
CN-118290461-A Isocyanate polymerization catalyst and preparation method thereof, and preparation method of polyisocyanate 万华化学集团股份有限公司 2024-07-05 CN claimed
CN-118287135-A Isocyanate polymerization catalyst and preparation method thereof, polyisocyanate composition and preparation method thereof 万华化学集团股份有限公司 2024-07-05 CN claimed
CN-1502605-A Prepartion of polyisocyanates containing uretdione groups 2004-06-09 CN claimed
WO-2004022623-A1 WATER EMULSIFABLE ISOCYANATES HAVING IMPROVED PROPERTIES BASF AKTIENGESELLSCHAFT (DE) 2004-03-18 WO claimed
EP-1389223-A1 METHOD FOR PRODUCING POLYISOCYANATES Bayer Aktiengesellschaft (DE) 2004-02-18 EP claimed
EP-1366125-A2 PHOTODEGRADATION-RESISTANT ELECTRODEPOSITABLE COATING COMPOSITIONS AND PROCESSES RELATED THERETO PPG Industries Ohio, Inc. (US) 2003-12-03 EP claimed
WO-2003040244-A1 PHOTODEGRADATION-RESISTANT ELECTRODEPOSITABLE COATING COMPOSITIONS WITH IMPROVED THROW POWER AND PROCESSES RELATED THERETO PPG INDUSTRIES OHIO, INC. (US) 2003-05-15 WO claimed
WO-2002092658-A1 METHOD FOR PRODUCING POLYISOCYANATES BAYER AKTIENGESELLSCHAFT (DE) 2002-11-21 WO claimed
WO-2002070613-A2 PHOTODEGRADATION-RESISTANT ELECTRODEPOSITABLE COATING COMPOSITIONS AND PROCESSES RELATED THERETO PPG INDUSTRIES OHIO, INC. (US) 2002-09-12 WO claimed
CN-1365370-A Polyurethane resin composition for sealing optoelectric conversion devices MITSUI CHEMICALS INC (JP) 2002-08-21 CN claimed
CN-1334833-A Coating agents curable by addition to isocyanate groups and radiation-induced addition to activated carbon-carbon covalent double bonds BASF AG (DE) 2002-02-06 CN claimed
US-5776394-A Process for manufacturing cellulose fibres BASF AKTIENGESELLSCHAFT (DE) 1998-07-07 US claimed