SCHEMBL17865612

SCHEMBL17865612

CC1(C)C(=O)C(C)(C)C1=NO

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
SCHEMBL22556825 0.70
SCHEMBL3626473 0.69 CTSD (0.32)
SCHEMBL820210 0.69 CTSD (0.32)
SCHEMBL11680983 0.62
SCHEMBL22556904 0.59
SCHEMBL22556824 0.59 ALDH1A1 (0.30)
SCHEMBL3166077 0.58
SCHEMBL1482396 0.57 ALDH1A1 (0.32)
SCHEMBL15658134 0.56
SCHEMBL18603992 0.56 MEN1 (0.36)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12594700-B2 Coatings from polyisocyanurate coatings (rim) and their use in injection molding processes COVESTRO DEUTSCHLAND AG (DE) 2026-04-07 US disclosed
WO-2025226797-A1 KRED CATALYZED KETOREDUCTION OF A CYCLOBUTANONE CARBAMIC ESTER GENENTECH, INC. (US) 2025-10-30 WO disclosed
US-12115791-B2 Ink jet recording apparatus and maintenance method SEIKO EPSON CORPORATION 2024-10-15 US disclosed
EP-3825301-B1 XYLYLENEDIISOCYANATE COMPOSITION, XYLYLENEDIISOCYANATE-MODIFIED COMPOSITION, TWO-COMPONENT RESIN MATERIAL, AND RESIN MITSUI CHEMICALS INC (JP) 2024-04-17 EP disclosed
US-20240084167-A1 AQUEOUS COATING COMPOSITION FOR CORROSION PROTECTION ALLNEX AUSTRIA GMBH (AT) 2024-03-14 US disclosed
EP-3702421-B1 INK-JET INK COMPOSITION AND INK JET RECORDING METHOD SEIKO EPSON CORP (JP) 2023-10-18 EP disclosed
US-20230211530-A1 COATINGS FROM POLYISOCYANURATE COATINGS (RIM) AND THEIR USE IN INJECTION MOLDING PROCESSES COVESTRO DEUTSCHLAND AG (DE) 2023-07-06 US disclosed
EP-4175820-A1 COATINGS FROM POLYISOCYANURATE COATINGS (RIM) AND THEIR USE IN INJECTION MOLDING PROCESSES Covestro Deutschland AG (DE) 2023-05-10 EP disclosed
US-20220098424-A1 Ink Jet Ink Set And Recording Method SEIKO EPSON CORPORATION (JP) 2022-03-31 US disclosed
WO-2022059774-A1 WATER-DISPERSIBLE BLOCKED ISOCYANATE, FIBER-TREATING AGENT, WATER REPELLENT, COATING COMPOSITION, AND ADHESIVE 三井化学株式会社 2022-03-24 WO disclosed
US-20190292304-A1 Xylylenediisocyanate composition, xylylenediisocyanate-modified composition, two-component resin material, and resin MITSUI CHEMICALS, INC. (JP) 2019-09-26 US disclosed
US-10385157-B2 Blocked isocyanate, coating composition, adhesive composition, and article MITSUI CHEMICALS, INC. (JP) 2019-08-20 US disclosed
US-20190249021-A1 PIGMENT TEXTILE PRINTING INK JET INK COMPOSITION, PIGMENT TEXTILE PRINTING INK JET INK COMPOSITION SET, AND INK JET PIGMENT TEXTILE PRINTING METHOD SEIKO EPSON CORPORATION (JP) 2019-08-15 US disclosed
EP-3524728-A1 PIGMENT TEXTILE PRINTING INK JET INK COMPOSITION, PIGMENT TEXTILE PRINTING INK JET INK COMPOSITION SET, AND INK JET PIGMENT TEXTILE PRINTING METHOD Seiko Epson Corporation (JP) 2019-08-14 EP disclosed
EP-3521507-A1 TREATMENT LIQUID COMPOSITION FOR INK JET PIGMENT TEXTILE PRINTING, TREATMENT LIQUID COMPOSITION SET FOR INK JET PIGMENT TEXTILE PRINTING, AND INK JET TEXTILE PRINTING METHOD Seiko Epson Corporation (JP) 2019-08-07 EP disclosed
US-20190234015-A1 TREATMENT LIQUID COMPOSITION FOR INK JET PIGMENT TEXTILE PRINTING, TREATMENT LIQUID COMPOSITION SET FOR INK JET PIGMENT TEXTILE PRINTING, AND INK JET TEXTILE PRINTING METHOD SEIKO EPSON CORPORATION (JP) 2019-08-01 US disclosed
EP-3470393-A1 XYLYLENE DIISOCYANATE COMPOSITION, XYLYLENE DIISOCYANATE MODIFICATION COMPOSITION, TWO-COMPONENT RESIN STARTING MATERIAL, AND RESIN Mitsui Chemicals, Inc. (JP) 2019-04-17 EP disclosed
EP-3284765-A1 BLOCKED ISOCYANATE, COATING COMPOSITION, ADHESIVE COMPOSITION, AND ARTICLE Mitsui Chemicals, Inc. (JP) 2018-02-21 EP disclosed
US-20160200858-A1 BLOCKED ISOCYANATE, COATING COMPOSITION, ADHESIVE COMPOSITION, AND ARTICLE MITSUI CHEMICALS, INC. (JP) 2016-07-14 US disclosed
EP-3037450-A1 BLOCKED ISOCYANATE, COATING COMPOSITION, ADHESIVE AGENT COMPOSITION, AND ARTICLE Mitsui Chemicals, Inc. (JP) 2016-06-29 EP disclosed