SCHEMBL2598046

SCHEMBL2598046

CC12CCC(CC1)C2.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
SCHEMBL27852613 1.00
SCHEMBL68868 0.84
Ammonia Solution, Strong SCHEMBL27505052 0.82
Bicarbonate SCHEMBL3420781 0.78 LMNA (0.38)
SCHEMBL1164719 0.75
SCHEMBL8747522 0.74 TSHR (0.38)
SCHEMBL17098852 0.73
SCHEMBL17098246 0.73 ALDH1A1 (0.34)
SCHEMBL28873726 0.71 TSHR (0.43)
SCHEMBL4270904 0.71 APLNR (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 54 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106574036-B Polyester polyurethane 德莎欧洲股份公司 2020-03-17 CN claimed
US-20260146123-A1 Curable Composition LG CHEM, LTD. (KR) 2026-05-28 US disclosed
US-12344743-B2 Curing composition SUNSTAR ENGINEERING INC. (JP) 2025-07-01 US disclosed
EP-4524173-A1 CURABLE COMPOSITION LG Chem, Ltd. (KR) 2025-03-19 EP disclosed
CN-119562980-A Curable composition 株式会社LG化学 2025-03-04 CN disclosed
CN-119487094-A Curable composition 株式会社LG化学 2025-02-18 CN disclosed
CN-119487114-A Curable composition 株式会社LG化学 2025-02-18 CN disclosed
EP-4446355-A1 CHLORINE-CONTAINING POLYETHER POLYOL COMPOSITION Tosoh Corporation (JP) 2024-10-16 EP disclosed
US-20240301267-A1 Curable Composition LG CHEM, LTD. (KR) 2024-09-12 US disclosed
WO-2024058581-A1 CURABLE COMPOSITION 주식회사 엘지화학 2024-03-21 WO disclosed
US-20120171480-A1 ADHESIVE COMPOSITION AND OPTICAL MEMBER USING THE SAME Wuxi Hengxin Optoelectronic Materials Co., Ltd. (CN) 2012-07-05 US disclosed
WO-2011144995-A1 A POLYMERIZATION CATALYST FOR POLYTHIOURETHANES, POLYMERIZABLE LIQUID COMPOSITION AND PROCESS FOR THE PRODUCTION OF ORGANIC POLYTHIOURETHANE GLASS WITH A HIGH REFRACTIVE INDEX ACOMON AG (CH) 2011-11-24 WO disclosed
EP-1970469-A2 Surface-modified metal member and method of modifying metal surface Nissan Motor Co., Ltd. (JP) 2008-09-17 EP disclosed
US-20080206520-A1 Surface-modified metal member and method of modifying metal surface NISSAN MOTOR CO., LTD. 2008-08-28 US disclosed
EP-1695987-A1 Thermoplastic elastomer composition THE YOKOHAMA RUBBER CO., LTD. (JP) 2006-08-30 EP disclosed
US-20060189755-A1 Thermoplastic elastomer composition THE YOKOHAMA RUBBER CO., LTD. 2006-08-24 US disclosed
EP-1074567-B1 Two-component type polyurethane composition and process of preparing the same MITSUI CHEMICALS INC (JP) 2004-10-27 EP disclosed
US-6649726-B1 Microstructured elastomers comprising isocyanate-2+ and curing agents having creep resistance, used as seals MITSUI CHEMICALS, INC. (JP) 2003-11-18 US disclosed
EP-1074567-A1 Two-component type polyurethane composition and process of preparing the same Mitsui Chemicals, Inc. (JP) 2001-02-07 EP disclosed
JP-2000073008-A WATERPROOF MATERIAL COMPOSED OF QUICK CURING POLYURETHANE COATING FILM CURABLE AT NORMAL TEMPERATURE, MENDING MATERIAL AND ITS PRODUCTION MITSUI CHEMICALS INC 2000-03-07 JP disclosed