SCHEMBL276565

SCHEMBL276565

CCC(C(N)=O)C(C)C

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
SCHEMBL4577996 0.81
SCHEMBL14554782 0.81
SCHEMBL8048401 0.81
Valnoctamide SCHEMBL5053817 0.81 CA1 (0.39)
SCHEMBL8046665 0.81
Valnoctamide SCHEMBL387435 0.81 CA1 (0.39)
SCHEMBL21883848 0.80 SLC1A3 (0.39)
SCHEMBL1577891 0.79 CA1 (0.41)
SCHEMBL6205731 0.79 CA1 (0.41)
SCHEMBL6204488 0.79 CA1 (0.41)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3817575-B1 SOLUBILISATION OF COOLING AGENTS OF LOW SOLUBILITY SYMRISE AG (DE) 2025-10-15 EP claimed
EP-2694505-B1 HSP90 INHIBITORS SLOAN KETTERING INST CANCER RES (US) 2022-04-27 EP claimed
US-10201623-B2 HSP90-targeted cardiac imaging and therapy MEMORIAL SLOAN KETTERING CANCER CENTER (US) 2019-02-12 US claimed
US-20160264577-A1 HSP90 INHIBITORS SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH 2016-09-15 US claimed
US-20140088121-A1 HSP90 Inhibitors SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 2014-03-27 US claimed
EP-2694505-A1 HSP90 INHIBITORS Sloan-kettering Institute For Cancer Research (US) 2014-02-12 EP claimed
WO-2012138894-A1 HSP90 INHIBITORS SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 2012-10-11 WO claimed
CN-102670350-A Cooling topical patch preparation TEIKOKU PHARMA USA INC 2012-09-19 CN claimed
CN-101094630-B topical cooling patch TEIKOKU PHARMA USA INC 2012-06-20 CN claimed
CN-101094630-A Topical cooling patch TEIKOKU PHARMA USA INC (US) 2007-12-26 CN claimed
CN-1390249-A Detergent composition PROCTER & GAMBLE (US) 2003-01-08 CN claimed
EP-1228181-A1 DETERGENT COMPOSITION The Procter & Gamble Company (US) 2002-08-07 EP claimed
WO-2001034753-A1 DETERGENT COMPOSITION THE PROCTER & GAMBLE COMPANY (US) 2001-05-17 WO claimed
US-4854973-A SHORT CHAIN CHLORINATED SOLVENTS NCH CORPORATION (US) 1989-08-08 US claimed
US-12616759-B2 Uses of labeled HSP90 inhibitors SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 2026-05-05 US disclosed
US-20250108023-A1 Products for Masking Bitterness The Third People's Hospital of Henan Province (CN) 2025-04-03 US disclosed
CN-117979961-A Stabilized compositions 鲁米兰特私人有限公司 2024-05-03 CN disclosed
US-4487772-A CARDIOTONIC AGENTS OTSUKA PHARMACEUTICAL CO. LTD. (JP) 1984-12-11 US disclosed
US-4468402-A Carbostyril derivatives, process for producing the same and cardiotonic compositions containing the same OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1984-08-28 US disclosed
US-4454130-A CARDIOTONIC, HYPOTENSIVE AGENTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1984-06-12 US disclosed