SCHEMBL1572948

SCHEMBL1572948

C#CC(C)(O)CO

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
SCHEMBL26793982 1.00
SCHEMBL4847148 0.77
Meparfynol SCHEMBL547715 0.75
Meparfynol SCHEMBL12864498 0.75
Meparfynol SCHEMBL78626 0.75
SCHEMBL25296087 0.73 ALDH1A1 (0.33)
SCHEMBL5069540 0.73
SCHEMBL12590808 0.73
Meparfynol SCHEMBL11215486 0.73
SCHEMBL5252984 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110951451-A Packaging adhesive for LED and preparation method thereof 肇庆皓明有机硅材料有限公司 2020-04-03 CN claimed
EP-3250571-B1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH INC (US) 2022-11-30 EP disclosed
CN-215939918-U System for coproduction methyl butynol and dimethyl hexynol 北京国联视讯信息技术股份有限公司 2022-03-04 CN disclosed
EP-3954679-A2 AMIDE COMPOUNDS FOR THE TREATMENT OF HIV INFECTIONS Gilead Sciences, Inc. (US) 2022-02-16 EP disclosed
EP-3409667-B1 AMIDE COMPOUNDS FOR THE TREATMENT OF HIV INFECTIONS GILEAD SCIENCES INC (US) 2021-07-21 EP disclosed
US-20210009555-A1 THERAPEUTIC COMPOUNDS GILEAD SCIENCES, INC. 2021-01-14 US disclosed
CN-110951451-A Packaging adhesive for LED and preparation method thereof 肇庆皓明有机硅材料有限公司 2020-04-03 CN disclosed
US-10202378-B2 Therapeutic compounds and uses thereof GENENTECH, INC. (US) 2019-02-12 US disclosed
EP-3409667-A1 AMIDE COMPOUNDS FOR THE TREATMENT OF HIV INFECTIONS Gilead Sciences, Inc. (US) 2018-12-05 EP disclosed
US-20180273508-A1 THERAPEUTIC COMPOUNDS GILEAD SCIENCES, INC. 2018-09-27 US disclosed
WO-2012159959-A1 2-AMINO-3-(IMIDAZOL-2-YL)-PYRIDIN-4-ONE DERIVATIVES AND THEIR USE AS VEGF RECEPTOR KINASE INHIBITORS SANOFI (FR) 2012-11-29 WO disclosed
EP-2524915-A1 2-Amino-3-(imidazol-2-yl)-pyridin-4-one derivatives and their use as VEGF receptor kinase inhibitors SANOFI (FR) 2012-11-21 EP disclosed
EP-2158201-B1 DERIVATIVES OF 7-ALKYNYL-1,8-NAPHTHYRIDONES, PREPARATION METHOD THEREOF AND USE OF SAME IN THERAPEUTICS SANOFI AVENTIS (FR) 2011-04-13 EP disclosed
US-20100144757-A1 DERIVATIVES OF 7-ALKYNYL-1,8-NAPHTHYRIDONES, PREPARATION METHOD THEREOF AND USE OF SAME IN THERAPEUTICS SANOFI-AVENTIS (FR) 2010-06-10 US disclosed
EP-2158201-A2 DERIVATIVES OF 7-ALKYNYL-1,8-NAPHTHYRIDONES, PREPARATION METHOD THEREOF AND USE OF SAME IN THERAPEUTICS Sanofi-Aventis (FR) 2010-03-03 EP disclosed
WO-2009007535-A2 DERIVATIVES OF 7-ALKYNYL-1,8-NAPHTHYRIDONES, PREPARATION METHOD THEREOF AND USE OF SAME IN THERAPEUTICS SANOFI-AVENTIS (FR) 2009-01-15 WO disclosed
US-7053141-B2 Organosilicone compounds having alkynol groups and the use thereof in crosslinkable materials WACKER-CHEMIE GMBH (DE) 2006-05-30 US disclosed
US-20060084744-A1 Silicone rubber composition comprising untreated aluminum hydroxide as filler WACKER-CHEMIE GMBH (DE) 2006-04-20 US disclosed
US-20040116566-A1 Organosilicone compounds having alkynol groups and the use thereof in crosslinkable materials WACKER-CHEMIE GMBH (DE) 2004-06-17 US disclosed
US-4057596-A POLYSILOXANE SHINETSU CHEMICAL COMPANY (JA) 1977-11-08 US disclosed