⚠ 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 | |
|---|---|---|---|---|
| Isothiocyanate SCHEMBL133963 | 1.00 | — | — | |
| Isothiocyanate SCHEMBL331482 | 1.00 | — | — | |
| Isothiocyanate SCHEMBL8940171 | 1.00 | ALDH1A1 (0.43) | — | |
| Isothiocyanate SCHEMBL331891 | 0.93 | ALDH1A1 (0.38) | — | |
| Isothiocyanate SCHEMBL550842 | 0.93 | — | — | |
| Isothiocyanate SCHEMBL20183932 | 0.93 | — | — | |
| Isothiocyanate SCHEMBL191111 | 0.93 | — | — | |
| Isothiocyanate SCHEMBL1534323 | 0.93 | — | — | |
| Isothiocyanate SCHEMBL6013846 | 0.93 | — | — | |
| Isothiocyanate SCHEMBL22204423 | 0.93 | — | — |
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 169081 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-6372755-B1 | — | — | None | — | — | US | claimed |
| US-20260146254-A1 | Enhancing Oligonucleotide Immunomodulatory Activity through Dianophore Long-Lasting Modification: Methods and Applications | SEGENA CORPORATION S.A. (UY) | 2026-05-28 | — | — | US | claimed |
| EP-4746918-A1 | METHODS OF PREPARING SURFACE MODIFIED VIRAL CAPSIDS | Borea Therapeutics S.r.l. (IT) | 2026-05-27 | — | — | EP | claimed |
| EP-4747295-A1 | OPTICAL MATERIAL DERIVED FROM A PREPOLYMER OBTAINED FROM A HETERODIFUNCTIONAL ALKYNE COMPOUND | ESSILOR INTERNATIONAL (FR) | 2026-05-27 | — | — | EP | claimed |
| EP-4746875-A2 | CARCINOGENESIS REDUCTION WITH PENTAAZA MACROCYCLIC RING COMPLEX | Galera Labs, LLC (US) | 2026-05-27 | — | — | EP | claimed |
| EP-4747411-A1 | MULTI-REPORTER SYSTEM FOR CHEMICAL SCREENING | Octant, Inc. (US) | 2026-05-27 | — | — | EP | claimed |
| CN-118117169-B | Special additive for electrolyte, electrolyte and lithium ion battery | TIANMU LAKE INSTITUTE OF ADVANCED ENERGY STORAGE TECHNOLOGIES Co.,Ltd. (CN) | 2026-05-26 | — | — | CN | claimed |
| CN-122080408-A | Carbon dioxide-based sulfur-containing terpolymer and preparation method thereof | — | 2026-05-26 | — | — | CN | claimed |
| CN-122080017-A | Compounds and uses thereof | — | 2026-05-26 | — | — | CN | claimed |
| CN-117050302-B | Angiopep-2 modified fluorescent polyamide-amine dendrimer, preparation method thereof and preparation method of nanoparticle based on same | XI'AN JIAOTONG UNIVERSITY (CN) | 2026-05-26 | — | — | CN | claimed |
| US-3981775-A | GRAFTING NITRO MONOMER ON TO POLYMER, AMINATION, DIAZOTIZATION, ISOTHIOCYANATO FORMATION | KENYON ROBERT SYDNEY | 1976-09-21 | — | — | US | claimed |
| US-3970458-A | PHOTOGRAPHY | EASTMAN KODAK COMPANY (US) | 1976-07-20 | — | — | US | claimed |
| US-3969436-A | Carriers for biologically active compounds and methods for the production thereof | CESKOSLOVENSKA AKADEMIE VED (CS) | 1976-07-13 | — | — | US | claimed |
| US-3964939-A | Bodies including passivated metal particles | BELL TELEPHONE LABORATORIES, INCORPORATED (US) | 1976-06-22 | — | — | US | claimed |
| US-3965113-A | 5(6)-Benzene ring substituted benzimidazole-2-carbamate derivatives having anthelmintic activity | SYNTEX (U.S.A.) INC. (US) | 1976-06-22 | — | — | US | claimed |
| US-3954685-A | Sulfur foam product and process | CHEVRON RESEARCH COMPANY (US) | 1976-05-04 | — | — | US | claimed |
| US-3953488-A | Method for preparing aliphatic and cycloaliphatic isothiocyanates | OLIN CORPORATION (US) | 1976-04-27 | — | — | US | claimed |
| US-3947570-A | MOUTHWASH, LEMON OIL | COLGATE-PALMOLIVE COMPANY (US) | 1976-03-30 | — | — | US | claimed |
| US-3932318-A | COPOLYMERS WITH ISOCYANATES, CRYOGENIC POLYMERIZATION, NONFLAMMABLE | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1976-01-13 | — | — | US | claimed |
| US-3931219-A | Process for preparing hexahydrothieno[3,4-d]imidazole-2,4-diones | SUMITOMO CHEMICAL COMPANY, LIMITED (JA) | 1976-01-06 | — | — | US | claimed |