SCHEMBL958653

SCHEMBL958653

[CH2]CCC(O)(O)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
SCHEMBL864556 0.77
SCHEMBL6633889 0.74
SCHEMBL27821615 0.72
SCHEMBL3195615 0.72
SCHEMBL1419968 0.70
SCHEMBL10995801 0.69
SCHEMBL125055 0.69
SCHEMBL2307954 0.69
SCHEMBL12005184 0.69
SCHEMBL997476 0.67

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
US-20220161868-A1 Vehicle Roof Comprising a Painted Rigid Roof Module Webasto SE (DE) 2022-05-26 US claimed
EP-2049543-B1 ACYCLIC AMINE INHIBITORS OF 5'-METHYLTHIOADENOSINE PHOSPHORYLASE AND NUCLEOSIDASE CALLAGHAN INNOVATION RES LTD (NZ) 2014-11-05 EP claimed
US-8853224-B2 Acyclic amine inhibitors of nucleoside phosphorylases and hydrolases INDUSTRIAL RESEARCH LIMITED (NZ) 2014-10-07 US claimed
CN-101528749-B Acyclic amine inhibitors of nucleoside phosphorylases and hydrolases IND RES LTD 2013-07-31 CN claimed
US-8383636-B2 Acyclic amine inhibitors of 5-methytioadenosine phosphorylase and nucleosidase INDUSTRIAL RESEARCH LIMITED (NZ) 2013-02-26 US claimed
EP-2395005-A1 Acyclic amine inhibitors of nucleoside phosphorylases and hydrolases Industrial Research Limited (NZ) 2011-12-14 EP claimed
EP-2348854-A2 METHODS AND COMPOSITIONS FOR TREATING BACTERIAL INFECTIONS BY INHIBITING QUORUM SENSING Albert Einstein College Of Medecine Of Yeshiva University (US) 2011-08-03 EP claimed
US-20110130412-A1 Acyclic amine inhibitors of nucleoside phosphorylases and hydrolases BIOCRYST PHARMACEUTICALS, INC. 2011-06-02 US claimed
EP-2057165-B1 ACYCLIC AMINE INHIBITORS OF NUCLEOSIDE PHOSPHORYLASES AND HYDROLASES IND RES LTD (NZ) 2011-03-16 EP claimed
US-20110046167-A1 ACYCLIC AMINE INHIBITORS OF 5-METHYTIOADENOSINE PHOSPHORYLASE AND NUCLEOSIDASE ALBERT EINSTEIN COLLEGE OF MEDICINE 2011-02-24 US claimed
US-6291198-B1 REACTING 1,2-DICARBONYL DERIVATIVE WITH DIAMINE FOR IMMUNOLOGICAL DETERMINATION; MEASUREMENT OF ANTIGEN-ANTIBODY COMPLEX; DIABETES DIAGNOSIS THE FUJIREBIO INC. (JP) 2001-09-18 US claimed
CN-1305458-A Diaryl selenium compounds and their use in human or veterinary medicine and in cosmetics GALDERMA RES & DEV (FR) 2001-07-25 CN claimed
CN-1273239-A (Poly) thia acetylenic acid and it derivative, composite containing them and its application OREAL (FR) 2000-11-15 CN claimed
WO-2000061194-A2 SHORT-CHAIN PEPTIDE DYE CONJUGATES USED AS CONTRAST AGENTS FOR OPTICAL DIAGNOSTICS Institut für Diagnostikforschung GmbH an der Freien Universität Berlin (DE) 2000-10-19 WO claimed
WO-2000009169-A1 NON-PORPHYRIN COMPOUND FOR USE AS A DIAGNOSTICUM AND/OR PHARMACEUTICAL K.U. LEUVEN RESEARCH & DEVELOPMENT (BE) 2000-02-24 WO claimed
EP-0436316-A1 X-ray contrast media for prolonged opacification Sovak, Milos (US) 1991-07-10 EP claimed
EP-0292348-A1 Polycyclic heterocyclic derivatives, proces for their preparation and their use in human and veterinary medicines CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA - CIRD GALDERMA Groupement d'Intérêt Economique dit: (FR) 1988-11-23 EP claimed
US-4547357-A OPACIFIER FOR X-RAY DIAGNOSIS SCHERING, AKTIENGESELLSCHAFT (DE) 1985-10-15 US claimed
EP-0033426-B1 TRIIODOBENZOYL DERIVATIVES USEFUL AS NON-IONIC CONTRAST MEDIA AND AMINO-DIOXEPANE INTERMEDIATES FOR THEIR SYNTHESIS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1985-07-10 EP claimed
EP-0033426-A2 Triiodobenzoyl derivatives useful as non-ionic contrast media and amino-dioxepane intermediates for their synthesis THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1981-08-12 EP claimed