SCHEMBL1160110

SCHEMBL1160110

O=C=NC1(CCC2(N=C=O)CCCCC2)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
SCHEMBL15262017 0.91
SCHEMBL11052365 0.87
SCHEMBL28002 0.85
SCHEMBL49906 0.85
SCHEMBL11042954 0.83 CETP (0.31)
SCHEMBL4945480 0.82
SCHEMBL1528422 0.82
SCHEMBL3826644 0.81
SCHEMBL1479371 0.81
SCHEMBL48237 0.81 ALDH1A1 (0.30)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2411433-B1 POLYURETHANES, ARTICLES AND COATINGS PREPARED THEREFROM AND METHODS OF MAKING THE SAME PPG IND OHIO INC (US) 2018-06-20 EP claimed
US-6743888-B1 HAVING PROTECTED PENDANT HYDROXYL GROUP CAPABLE OF CROSS-LINKING WITH POLYISOCYANATE; ROBUST DURABLE PHOTOCONDUCTIVE IMAGING MEMBERS; SOLVENT AND ABRASION RESISTANCE XEROX CORPORATION 2004-06-01 US claimed
EP-0603376-A1 SIZE COMPOSITION. OWENS CORNING FIBERGLASS CORP (US) 1994-06-29 EP claimed
WO-1994001375-A1 SIZE COMPOSITION OWENS-CORNING FIBERGLAS CORPORATION (US) 1994-01-20 WO claimed
EP-2814860-B1 ELASTOMERS FOR PAPER MILL EQUIPMENT DOW GLOBAL TECHNOLOGIES LLC (US) 2020-10-14 EP disclosed
US-20200248054-A1 POLYURETHANE ADHESIVE LAYERS FOR ELECTRO-OPTIC ASSEMBLIES E INK CORPORATION 2020-08-06 US disclosed
EP-2791195-B1 ESTER CARBONATE POLYOLS FOR HYDROLITICALLY STABLE ADHESIVES DOW GLOBAL TECHNOLOGIES LLC (US) 2018-11-21 EP disclosed
EP-2939695-B1 POLYMERIC COUPLING AGENTS AND PHARMACEUTICALLY-ACTIVE POLYMERS MADE THEREFROM INTERFACE BIOLOGICS INC (CA) 2018-08-29 EP disclosed
WO-2018149977-A1 REACTIVE THERMOPLASTIC POLYURETHANE BASED ON BLOCKED ISOCYANATES BASF SE (DE) 2018-08-23 WO disclosed
EP-3126425-A1 NATURAL OIL DERIVED BLOCKED PREPOLYMERS AND ACRYLIC PLASTISOL COMPOSITIONS HAVING THE BLOCKED PREPOLYMERS Dow Global Technologies LLC (US) 2017-02-08 EP disclosed
US-20170022317-A1 NATURAL OIL DERIVED BLOCKED PREPOLYMERS AND ACRYLIC PLASTISOL COMPOSITIONS HAVING THE BLOCKED PREPOLYMERS DOW GLOBAL TECHNOLOGIES LLC (US) 2017-01-26 US disclosed
US-9440326-B2 Non-planar glass polishing pad and method of manufacture JH RHODES COMPANY, INC. (US) 2016-09-13 US disclosed
US-5117044-A Unsaturated ester NIPPON PAINT CO., LTD. (JP) 1992-05-26 US disclosed
US-5102951-A Curable compound NIPPON PAINT CO., LTD. (JP) 1992-04-07 US disclosed
US-5081183-A Active hydrogen compound reacted with oxalic acid diester or acyl halide, curing agents NIPPON PAINT CO., LTD. (JP) 1992-01-14 US disclosed
US-4902727-A Compounds having a polymerizable acylurethane structure, and their production and process of using NIPPON PAINT CO., LTD. (JP) 1990-02-20 US disclosed
EP-0204497-A1 Polymerisation process employing compounds having polymerisable acylurethane structures Nippon Paint Co., Ltd. (JP) 1986-12-10 EP disclosed
US-4251580-A OF A THERMOPLASTIC, POLYURETHANE-CONTAINING COPOLYMER IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) 1981-02-17 US disclosed
US-4210713-A HIDING POWER NIPPON PAINT CO., LTD. (JP) 1980-07-01 US disclosed
US-4089844-A INTERNAL PLASTICIZER GROW CHEMICAL CORP. (US) 1978-05-16 US disclosed