⚠ 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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL1784891 | 0.65 | — | — | |
| SCHEMBL28753826 | 0.65 | — | — | |
| SCHEMBL1119968 | 0.62 | — | — | |
| SCHEMBL195841 | 0.61 | — | — | |
| SCHEMBL8755036 | 0.61 | — | — | |
| SCHEMBL28396651 | 0.59 | — | — | |
| SCHEMBL17732197 | 0.59 | — | — | |
| SCHEMBL787773 | 0.59 | — | — | |
| SCHEMBL18261219 | 0.56 | — | — | |
| SCHEMBL42931 | 0.56 | — | — |
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 53 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108165330-A | A kind of method of one step recycling of plant and energy after soil remediation | 中山大学 | 2018-06-15 | — | — | CN | claimed |
| CN-105461557-B | Method for palladium/phosphite ligand catalyzed asymmetric allylic alkylation reaction | 中国科学院兰州化学物理研究所 | 2017-04-26 | — | — | CN | claimed |
| US-7998986-B2 | Heterocyclic compounds, in particular N-substituted pyridones for modulating the activity of nuclear receptors | EXELIXIS PATENT COMPANY LLC (US) | 2011-08-16 | — | — | US | claimed |
| EP-1465869-A4 | MODULATORS OF LXR | X CEPTOR THERAPEUTICS INC (US) | 2005-12-28 | — | — | EP | claimed |
| JP-2005536450-A | — | — | 2005-12-02 | — | — | JP | claimed |
| US-6838017-B1 | Polar tolane liquid crystals | HRL LABORATORIES, LLC (US) | 2005-01-04 | — | — | US | claimed |
| WO-2004111062-A1 | PARA-PHENYLENEDIAMINE DERIVATIVES COMPRISING A DIAZACYCLOHEPTANE RING SUBSTITUTED WITH A SILYL RADICAL, FOR DYEING KERATIN FIBRES | L'OREAL (FR) | 2004-12-23 | — | — | WO | claimed |
| EP-1465869-A1 | MODULATORS OF LXR | X-Ceptor Therapeutics, Inc. (US) | 2004-10-13 | — | — | EP | claimed |
| CN-1481365-A | Cyclization process steps for making quinolones and naphthyridines | — | 2004-03-10 | — | — | CN | claimed |
| US-20030181420-A1 | Heterocyclic compounds, in particular N-substituted pyridones for modulating the activity of nuclear receptors | EXELIXIS, INC. | 2003-09-25 | — | — | US | claimed |
| WO-2003059884-A1 | MODULATORS OF LXR | X-CEPTOR THERAPEUTICS, INC. (US) | 2003-07-24 | — | — | WO | claimed |
| EP-1315783-A2 | POLAR TOLANE LIQUID CRYSTALS | HRL Laboratories, LLC (US) | 2003-06-04 | — | — | EP | claimed |
| WO-2002020697-A2 | POLAR TOLANE LIQUID CRYSTALS | HRL LABORATORIES, LLC (US) | 2002-03-14 | — | — | WO | claimed |
| CN-1092554-A | Form the method for Micropicture | SAMSUNG ELECTRONICS CO LTD (KR) | 1994-09-21 | — | — | CN | claimed |
| CN-115594694-A | Preparation method of delta 3-type capecitate | 凌晟（武汉）生物医药技术有限公司（CN） | 2023-01-13 | — | — | CN | disclosed |
| EP-4027993-A1 | CYCLOOXYGENASE-2 INHIBITORS AND USES THEREOF | The Broad Institute Inc. (US) | 2022-07-20 | — | — | EP | disclosed |
| CN-113444117-B | Star-shaped compound of BODIPY bridged tetraperylene diimide derivative and preparation method thereof | 南京林业大学 | 2022-04-19 | — | — | CN | disclosed |
| CN-1119867-A | Cephalosporin derivative | YAMANOUCHI PHARMA CO LTD (JP) | 1996-04-03 | — | — | CN | disclosed |
| WO-1988006603-A1 | PREPARING GRAFT COPOLYMERS AND BRANCHED HOMOPOLYMERS | Röhm GmbH Chemische Fabrik (DE) | 1988-09-07 | — | — | WO | disclosed |
| US-4714777-A | Cyclopropanone hydrate derivatives | UNIVERSITY OF PITTSBURGH (US) | 1987-12-22 | — | — | US | disclosed |