SCHEMBL49906

SCHEMBL49906

O=C=NCCC1(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
SCHEMBL1528422 0.89
SCHEMBL4945480 0.89
SCHEMBL28181515 0.85
SCHEMBL9304447 0.85
SCHEMBL1477620 0.85
SCHEMBL5900987 0.85
SCHEMBL1160110 0.85
SCHEMBL15262017 0.81
SCHEMBL48237 0.81 ALDH1A1 (0.30)
SCHEMBL5611394 0.79

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 1268 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
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-4134386-B1 ADDUCT COMPOSITIONS MADE OF DIISOCYANATES AND HYDROXY- OR AMINO-FUNCTIONALIZED ALKYLSULFONIC ACIDS AND/OR ALKYLSULFONIC ACID DERIVATIVES EVONIK OPERATIONS GMBH (DE) 2023-11-08 EP claimed
US-20230303756-A1 MULTIFUNCTIONAL POLYOL RESINS, CURABLE COMPOSITIONS, AND METHODS THEREOF MAINSTREAM PINE PRODUCTS, LLC 2023-09-28 US claimed
US-20230250291-A1 A METHOD FOR REDUCING HYDROGEN SULFIDE EMISSIONS DURING PRODUCTION OF ASPHALT COMPOSITION BASF SE (DE) 2023-08-10 US claimed
EP-4219581-A1 MULTIFUNCTIONAL POLYOL RESINS, CURABLE COMPOSITIONS, AND METHODS THEREOF Ingevity South Carolina, LLC (US) 2023-08-02 EP claimed
US-20030212205-A1 Powder coatings based on thermoset-modified polymers and polyesters DEGUSSA AG (DE) 2003-11-13 US claimed
EP-1361234-A1 Process for the solventless, continuous preparation of polyureas Degussa AG (DE) 2003-11-12 EP claimed
EP-1361237-A1 Preparation of polymers and thermosets Degussa AG (DE) 2003-11-12 EP claimed
US-6610812-B1 Acid functional group based on a carboxylic, sulfonic or phosphonic acid ACUSHNET COMPANY 2003-08-26 US claimed
US-20030135007-A1 Catalysts for preparing polyisocyanates containing isocyanurate groups, and their use DEGUSSA AG (DE) 2003-07-17 US claimed
US-20030109665-A1 Catalysts for preparing polyisocyanates containing isocyanurate groups, and their use DEGUSSA AG (DE) 2003-06-12 US claimed
EP-1318152-A2 Catalysts and process for preparing polyisocyanates containing isocyanurate groups and their use Degussa AG (DE) 2003-06-11 EP claimed
EP-1318160-A1 Catalysts and process for the preparation of isocyanurate group containing polyisocyanates and their use Degussa AG (DE) 2003-06-11 EP claimed
US-20030096936-A1 Golf balls comprising light stable materials and methods of making the same JPMORGAN CHASE BANK, N.A., AS SUCCESSOR ADMINISTRATIVE AGENT 2003-05-22 US claimed
US-20030088048-A1 Golf ball comprising saturated polyurethanes and methods of making the same JPMORGAN CHASE BANK, N.A., AS SUCCESSOR ADMINISTRATIVE AGENT 2003-05-08 US claimed