SCHEMBL48535

SCHEMBL48535

O=C=NC1(N=C=O)CC=CC=C1c1ccccc1

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
SCHEMBL9695361 0.83 CYP3A4 (0.35)
SCHEMBL28472262 0.81
SCHEMBL28467698 0.81
SCHEMBL28470140 0.81
SCHEMBL28478955 0.80
SCHEMBL28594157 0.78
SCHEMBL28476608 0.77 ALDH1A1 (0.30)
SCHEMBL28471913 0.76
SCHEMBL28475905 0.75 OPRM1 (0.32)
SCHEMBL1990517 0.72 SMN1; SMN2 (0.32)

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 786 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
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
EP-3864063-B1 A PROCESS FOR PREPARING A PREPREG BINDER COMPOSITION, A PREPREG AND USE THEREOF BASF SE (DE) 2023-11-29 EP claimed
US-20230303756-A1 MULTIFUNCTIONAL POLYOL RESINS, CURABLE COMPOSITIONS, AND METHODS THEREOF MAINSTREAM PINE PRODUCTS, LLC 2023-09-28 US claimed
EP-4219581-A1 MULTIFUNCTIONAL POLYOL RESINS, CURABLE COMPOSITIONS, AND METHODS THEREOF Ingevity South Carolina, LLC (US) 2023-08-02 EP claimed
US-7799874-B2 Catalytic compositions PERSTORP SPECIALTY CHEMICALS AB (SE) 2010-09-21 US claimed
US-7786243-B2 Polyurea and polyurethane compositions for golf equipment ACUSHNET COMPANY (US) 2010-08-31 US claimed
US-20100125002-A1 RESIN COMPOSITIONS INCORPORATING MODIFIED POLYISOCYANATE AND METHOD FOR THEIR MANUFACTURE AND USE TAYLOR MADE GOLF COMPANY, INC. 2010-05-20 US claimed
US-20090149278-A1 Polyurea and Polyurethane Compositions for Golf Equipment JPMORGAN CHASE BANK, N.A., AS SUCCESSOR ADMINISTRATIVE AGENT 2009-06-11 US claimed
US-20080050995-A1 Hydroxyl-Terminated Thiocarbonate Containing Compounds, Polymers, and Copolymers, and Polyurethanes and Urethane Acrylics Made Therefrom LUBRIZOL ADVANCED MATERIALS, INC. 2008-02-28 US claimed
EP-1786848-A1 POLYURETHANES AND URETHANE ACRYLICS MADE FROM HYDROXYL-TERMINATED THIOCARBONATE CONTAINING COMPOUNDS Noveon, Inc. (US) 2007-05-23 EP claimed
US-7131915-B2 Three-layer-cover golf ball ACUSHNET COMPANY (US) 2006-11-07 US claimed
WO-2006023790-A1 CURABLE THIOCARBONATE COMPOUNDS AND COMPOSITIONS NOVEON, INC. (US) 2006-03-02 WO claimed
WO-2006020281-A1 POLYURETHANES AND URETHANE ACRYLICS MADE FROM HYDROXYL-TERMINATED THIOCARBONATE CONTAINING COMPOUNDS NOVEON, INC. (US) 2006-02-23 WO claimed
US-20040235587-A1 Three-layer-cover golf ball JPMORGAN CHASE BANK, N.A., AS SUCCESSOR ADMINISTRATIVE AGENT 2004-11-25 US claimed