SCHEMBL1834565

SCHEMBL1834565

C=C(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
SCHEMBL5355938 0.73
SCHEMBL3485484 0.69
SCHEMBL2148358 0.69
SCHEMBL11122144 0.69 SLC22A6 (0.30)
SCHEMBL7792697 0.69 ALDH1A1 (0.36)
SCHEMBL10446021 0.69
SCHEMBL13821486 0.69
SCHEMBL182649 0.69
SCHEMBL17167061 0.69
SCHEMBL4775227 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113845403-B Preparation method for co-production of 2-methyl-1, 3-propanediol and pentaerythritol 万华化学集团股份有限公司 2023-08-11 CN claimed
CN-113845403-A Preparation method for co-production of 2-methyl-1, 3-propylene glycol and pentaerythritol 万华化学集团股份有限公司 2021-12-28 CN claimed
US-20150335535-A1 DENTAL ADHESIVE DENTSPLY INT INC (US) 2015-11-26 US claimed
US-8198388-B2 One-part self-etching, self-priming dental adhesive composition DENTSPLY INTERNATIONAL INC. (US) 2012-06-12 US claimed
JP-4594297-B2 2010-12-08 JP claimed
US-20090043008-A1 Dental adhesive KLEE JOACHIM E 2009-02-12 US claimed
US-20070293642-A1 One-Part Self-Etching, Self-Priming Dental Adhesive Composition DENTSPLY DE TREY GMBH (DE) 2007-12-20 US claimed
JP-2007520465-A 2007-07-26 JP claimed
WO-2007045303-A1 DENTAL ADHESIVE DENTSPLY DE TREY GMBH (DE) 2007-04-26 WO claimed
EP-1776943-A1 Dental adhesive DENTSPLY DETREY GmbH (DE) 2007-04-25 EP claimed
EP-1548021-B1 One-part self-etching, self-priming dental adhesive composition DENTSPLY DETREY GMBH (DE) 2007-03-21 EP claimed
US-20060246017-A1 Polymerizable phosphoric acid ester derivative and a dental composition employing it DENTSPLY DE TREY GMBH (DE) 2006-11-02 US claimed
JP-2006520344-A 2006-09-07 JP claimed
EP-1601679-A2 A POYMERIZABLE PHOSPHORIC ACID ESTER DERIVATIVE AND A DENTAL COMPOSITION EMPLOYING IT. DENTSPLY DETREY GmbH (DE) 2005-12-07 EP claimed
WO-2005063778-A1 ONE-PART SELF-ETCHING, SELF-PRIMING DENTAL ADHESIVE COMPOSITION DENTSPLY DETREY GMBH (DE) 2005-07-14 WO claimed
EP-1548021-A1 One-part self-etching, self-priming dental adhesive composition DENTSPLY DETREY GmbH (DE) 2005-06-29 EP claimed
WO-2004078100-A2 A POYMERIZABLE PHOSPHORIC ACID ESTER DERIVATIVE AND A DENTAL COMPOSITION EMPLOYING IT. DENTSPLY DE TREY GMBH (DE) 2004-09-16 WO claimed
EP-1454911-A1 A polymerizable phosphoric acid ester derivative and a dental composition employing it DENTSPLY DETREY GmbH (DE) 2004-09-08 EP claimed
US-20260036904-A1 PHOTOSENSITIVE RESIN COMPOSITION, METHOD FOR PRODUCING CURED RELIEF PATTERN, AND SEMICONDUCTOR DEVICE ASAHI KASEI KABUSHIKI KAISHA (JP) 2026-02-05 US disclosed
US-3983223-A ALKALI CARBONATE, HYDROGEN PEROXIDE, POLYMERIC CARBOXYLATE DEUTSCHE GOLD- UND SILBER-SCHEIDEANSTALT VORMALS ROESSLER (DT) 1976-09-28 US disclosed