⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17287976 | 0.86 | APP (0.41) | — | |
| SCHEMBL8443302 | 0.82 | CYP1A2 (0.52) | — | |
| SCHEMBL10863333 | 0.81 | APP (0.32) | — | |
| SCHEMBL40533 | 0.77 | APP (0.60) | — | |
| SCHEMBL195785 | 0.76 | MAOA (0.61) | — | |
| SCHEMBL11859124 | 0.74 | APP (0.56) | — | |
| SCHEMBL7551334 | 0.73 | — | — | |
| SCHEMBL443989 | 0.71 | — | — | |
| Diphenylacetylene SCHEMBL7080226 | 0.71 | APP (0.71) | — | |
| Diphenylacetylene SCHEMBL339222 | 0.69 | APP (0.60) | — |
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
Appears in 9465 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6384031-B1 | — | — | None | — | — | US | claimed |
| CN-118271331-A | Gelsemin derivatives, synthesis method and application thereof in inhibiting tumor cell proliferation | 赣江中药创新中心 | 2024-07-02 | — | — | CN | claimed |
| CN-118164997-A | Sesquiterpene lactone scaberol C thioether derivative, and preparation method and application thereof | 沈阳药科大学 | 2024-06-11 | — | — | CN | claimed |
| WO-2024119101-A1 | STIMULI-RESPONSIVE TRACELESS ENGINEERING PLATFORM FOR INTRACELLULAR PAYLOAD DELIVERY | YALE UNIVERSITY (US) | 2024-06-06 | — | — | WO | claimed |
| CN-118126247-A | Modified polystyrene and preparation method thereof | 复旦大学 | 2024-06-04 | — | — | CN | claimed |
| CN-116621767-B | Isatin derivative and preparation method and application thereof | 中山大学 | 2024-05-31 | — | — | CN | claimed |
| WO-2024107755-A1 | SINGLE-MOLECULE PEPTIDE SEQUENCING USING DITHIOESTER AND THIOCARBAMOYL AMINO ACID REACTIVE GROUPS | GLYPHIC BIOTECHNOLOGIES, INC. (US) | 2024-05-23 | — | — | WO | claimed |
| US-11958920-B2 | Active energy ray curable composition | ASIA STENCIL PAPER CO., LTD. (JP) | 2024-04-16 | — | — | US | claimed |
| WO-2024044513-A1 | HYBRID ORGANIC-INORGANIC TWO-DIMENSIONAL METAL CARBIDE MXENES | THE UNIVERSITY OF CHICAGO (US) | 2024-02-29 | — | — | WO | claimed |
| CN-113968824-B | 2,3, 5-trisubstituted pyrazine compound and preparation method and application thereof | 郑州大学 | 2024-01-19 | — | — | CN | claimed |
| US-4232030-A | ANTIBIOTICS | MERCK & CO., INC. (US) | 1980-11-04 | — | — | US | claimed |
| US-4228074-A | Azetidinone derivatives | GLAXO LABORATORIES LIMITED (GB) | 1980-10-14 | — | — | US | claimed |
| US-4226870-A | ANTIBIOTICS, BACTERICIDES | MERCK & CO., INC. (US) | 1980-10-07 | — | — | US | claimed |
| EP-0008196-A1 | Pentapeptides, processes for their preparation, intermediates used in such processes, use in pharmaceutical compositions and compositions containing them | AMERICAN HOME PRODUCTS CORPORATION (US) | 1980-02-20 | — | — | EP | claimed |
| EP-0001265-A1 | O-, N- and carboxyl derivatives of thienamycin sulfoxide and sulfone, their preparation and pharmaceuticals containing said compounds | MERCK & CO. INC. (US) | 1979-04-04 | — | — | EP | claimed |
| EP-0001264-A1 | Substituted N-methylene derivatives of thienamycin sulfoxide and sulfone and their preparation | MERCK & CO. INC. (US) | 1979-04-04 | — | — | EP | claimed |
| US-4110533-A | PROCESS FOR THE MANUFACTURE OF ENOL DERIVATIVES | CIBA-GEIGY CORPORATION (US) | 1978-08-29 | — | — | US | claimed |
| US-4011214-A | 3-(MORPHOLINOALKOXYIMINOMETHYL)CEPHEM COMPOUNDS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JA) | 1977-03-08 | — | — | US | claimed |
| US-3993646-A | Process for the ring expansion of penicillins to cephalosporin compounds | FUJISAWA PHARMACEUTICAL CO., LTD. (JA) | 1976-11-23 | — | — | US | claimed |
| US-3935198-A | BY HEATING THE PENICILLIN SULFOXIDE | YAMANOUCHI PHARMACEUTICAL CO., LTD. (JA) | 1976-01-27 | — | — | US | claimed |