⚠ 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 | |
|---|---|---|---|---|
| Phenylisothiocyanate SCHEMBL29672744 | 0.97 | MIF (0.94) | — | |
| Phenylisothiocyanate SCHEMBL27304859 | 0.97 | MIF (0.94) | — | |
| Phenylisothiocyanate SCHEMBL28153525 | 0.97 | MIF (0.94) | — | |
| Phenylisothiocyanate SCHEMBL29001974 | 0.97 | MIF (0.94) | — | |
| Phenylisothiocyanate SCHEMBL8978101 | 0.97 | MIF (0.94) | — | |
| Phenylisothiocyanate SCHEMBL25197976 | 0.97 | MIF (0.94) | — | |
| Phenylisothiocyanate SCHEMBL2399995 | 0.97 | MIF (0.94) | — | |
| Phenylisothiocyanate SCHEMBL28214195 | 0.97 | MIF (0.94) | — | |
| Phenylisothiocyanate SCHEMBL27084010 | 0.95 | MIF (0.90) | — | |
| Naphthalene SCHEMBL28447003 | 0.92 | MIF (0.85) | — |
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 11881 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 |
|---|---|---|---|---|---|---|---|
| EP-4728270-A1 | METHODS FOR DETECTING CATECHOLAMINES BY MASS SPECTROMETRY | Quest Diagnostics Investments LLC (US) | 2026-04-22 | — | — | EP | claimed |
| US-12606575-B2 | Method for synthesizing zirconium complex | JFE ENGINEERING CORPORATION (JP) | 2026-04-21 | — | — | US | claimed |
| US-12576429-B2 | Method of wetting low surface energy substrate and a system therefor | W. L. GORE & ASSOCIATES, INC. (US) | 2026-03-17 | — | — | US | claimed |
| US-20260054287-A1 | PASSIVATION COATING ON COPPER METAL SURFACE FOR COPPER WIRE BONDING APPLICATION | UNIV NORTH TEXAS (US) | 2026-02-26 | — | — | US | claimed |
| EP-4680677-A1 | BENZOTHIENOPYRROLE CYANINE DYES | Beckman Coulter, Inc. (US) | 2026-01-21 | — | — | EP | claimed |
| US-20260016480-A1 | SINGLE-MOLECULE PROTEIN AND PEPTIDE SEQUENCING | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 2026-01-15 | — | — | US | claimed |
| US-12493042-B2 | Molecules and methods for iterative polypeptide analysis and processing | WASHINGTON UNIVERSITY (US) | 2025-12-09 | — | — | US | claimed |
| US-20250364276-A1 | TUNABLE LOW-COST PASSIVATION COATING FOR FACILITATING FLUXLESS BONDING OF COPPER SOLDER INTERCONNECTS IN FLIP CHIP ASSEMBLY | UNIV NORTH TEXAS (US) | 2025-11-27 | — | — | US | claimed |
| US-12479004-B2 | Selective attachment to enhance SiO2:SiNx etch selectivity | LAM RESEARCH CORPORATION (US) | 2025-11-25 | — | — | US | claimed |
| US-12474347-B2 | Determination of protein information by recoding amino acid polymers into DNA polymers | ABRUS BIO, INC. (US) | 2025-11-18 | — | — | US | claimed |
| US-4430326-A | Method of diminishing glucose levels resulting from endogenous glucagon | UNIVERSITY PATENTS, INC. (US) | 1984-02-07 | — | — | US | claimed |
| EP-0073597-A1 | Process for polymerizing 1,3-butadiene | UBE INDUSTRIES, LTD. (JP) | 1983-03-09 | — | — | EP | claimed |
| US-4340685-A | SYNDIOTACTIC POLYMERIZATION CATALYST | JAPAN SYNTHETIC RUBBER CO., LTD. (JP) | 1982-07-20 | — | — | US | claimed |
| EP-0053915-A1 | Novel compounds and hapten-immunoglobulin conjugates derived from them | Lilly Industries Limited (GB) | 1982-06-16 | — | — | EP | claimed |
| EP-0002938-B1 | NOVEL HETEROCYCLIC CARBOTHIOAMIDES, COMPOSITIONS CONTAINING THEM, THEIR PREPARATION AND USE | ELI LILLY AND COMPANY (US) | 1982-05-12 | — | — | EP | claimed |
| EP-0002941-B1 | 2-SUBSTITUTED-N-(3-SUBSTITUTED PHENYL)- OXAZOLIDINE-3-CARBOTHIOAMIDES AND THEIR PREPARATION, COMPOSITIONS AND USE | ELI LILLY AND COMPANY (US) | 1982-04-21 | — | — | EP | claimed |
| US-4256833-A | USING A STABILIZED PEROXIDASE-LABELLED IMMUNOGLOBULIN CONJUGATE; DOSAGE DETERMINATION | VENTREX LABORATORIES, INC., A CORP OF | 1981-03-17 | — | — | US | claimed |
| EP-0002941-A2 | 2-Substituted-N-(3-substituted phenyl)- oxazolidine-3-carbothioamides and their preparation, compositions and use | ELI LILLY AND COMPANY (US) | 1979-07-11 | — | — | EP | claimed |
| EP-0002938-A2 | Novel heterocyclic carbothioamides, compositions containing them, their preparation and use | ELI LILLY AND COMPANY (US) | 1979-07-11 | — | — | EP | claimed |
| US-3977880-A | Direct-positive emulsion containing silver halide grains internally doped with metal ions, surface ripened with gold and sulfur compound and fogged by light exposure | FUJI PHOTO FILM CO., LTD. (JA) | 1976-08-31 | — | — | US | claimed |