SCHEMBL2652

SCHEMBL2652

CCOC(C)O[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
SCHEMBL4396257 0.88 LMNA (0.48)
SCHEMBL3670956 0.84 LMNA (0.39)
SCHEMBL3366779 0.80
SCHEMBL4396261 0.80 ALDH1A1 (0.34)
SCHEMBL3669079 0.80 LMNA (0.34)
SCHEMBL3367366 0.77 ALDH1A1 (0.33)
SCHEMBL2886819 0.77
SCHEMBL828245 0.77 CYP3A4 (0.33)
SCHEMBL126615 0.76 LMNA (0.67)
SCHEMBL5931988 0.76 THRB (0.53)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7847045-B2 Acrylic acid-based polymer and method of producing the same NIPPON SODA CO., LTD. (JP) 2010-12-07 US claimed
WO-2005105777-A1 SUBSTITUTED THIOPHENE AMIDE COMPOUNDS FOR THE TREATMENT OF INFLAMMATION PHARMACIA & UPJOHN COMPANY LLC (US) 2005-11-10 WO claimed
WO-2001091558-A1 HERBICIDAL AGENTS BASED ON SUBSTITUTED CARBOXAMIDES BAYER AKTIENGESELLSCHAFT (DE) 2001-12-06 WO claimed
US-5352774-A Colorfast blue dyes for plastics and synthetic fibers SANDOZ AG (CH) 1994-10-04 US claimed
EP-0352006-B1 THERMAL TRANSFER PRINTING IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-05-05 EP claimed
US-5013351-A Triazolo-pyrimidine-2-sulphonamides useful as herbicides BAYER AKTIENGESELLSCHAFT (DE) 1991-05-07 US claimed
US-5011812-A Substrate coating of binder and monoazo dye IMPERIAL CHEMICAL INDUSTRIES (GB) 1991-04-30 US claimed
EP-0352006-A2 Thermal transfer printing IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-01-24 EP claimed
EP-0337232-A1 Triazoloazines BAYER AG (DE) 1989-10-18 EP claimed
EP-0332029-A2 Triazolopyrimidine-2-sulfon amides BAYER AG (DE) 1989-09-13 EP claimed
US-4837269-A FIBER-REACTIVE DISAZO DYES BASF AKTIENGESELLSCHAFT (DE) 1989-06-06 US claimed
US-4837309-A IMPROVED COLORFASTNESS AND LIGHTFASTNESS MITSUBISHI CHEMICAL INDUSTRIES LIMITED (JP) 1989-06-06 US claimed
EP-0129207-B1 SUBSTITUTED PHENYLALKYL(PIPERAZINYL OR HOMOPIPERAZINYL)-PROPYL-(UREAS OR THIOUREAS) Boehringer Ingelheim Pharmaceuticals Inc. (US) 1988-03-16 EP claimed
US-4668775-A POLYESTERS, NYLON, CELLULOSE ESTERS, FIBERS, BLUE BASF AKTIENGESELLSCHAFT (DE) 1987-05-26 US claimed
US-4268671-A PERINONE DYES USED FOR DYEING POLYESTERS MITSUBISHI CHEMICAL INDUSTRIES LTD. (JP) 1981-05-19 US claimed
US-4148791-A DISPERSE DYES SANDOZ LTD. (CH) 1979-04-10 US claimed
US-4140684-A FOR POLYESTERS, POLYAMIDES, AND CELLULOSE ACETATES FIDELITY UNION TRUST COMPANY, EXECUTIVE TRUSTEE UNDER THE SANDOZ TRUST (US) 1979-02-20 US claimed
JP-59108769-A None JP disclosed
US-4083686-A AZO DYES, WASHFASTNESS, PHOTOSTABILITY, SOLVENT RESISTANCE BASF AKTIENGESELLSCHAFT (DT) 1978-04-11 US disclosed
US-4063025-A PROPHYLAXIS, ANTIASTHMATIC YAMANOUCHI PHARMACEUTICAL CO., LTD. (JA) 1977-12-13 US disclosed