⚠ 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 | |
|---|---|---|---|---|
| Water SCHEMBL28049243 | 1.00 | KDM4E (0.64) | — | |
| SCHEMBL12444126 | 1.00 | — | — | |
| SCHEMBL28251780 | 0.97 | KDM4E (0.61) | — | |
| Hydrochloric Acid SCHEMBL30942103 | 0.97 | KDM4E (0.61) | — | |
| SCHEMBL7375936 | 0.97 | KDM4E (0.61) | — | |
| SCHEMBL28783861 | 0.97 | KDM4E (0.61) | — | |
| SCHEMBL7929151 | 0.92 | MMP3 (0.58) | — | |
| SCHEMBL15934230 | 0.92 | KDM4E (0.57) | — | |
| SCHEMBL28311757 | 0.89 | KDM4E (0.55) | — | |
| Ammonia Solution, Strong SCHEMBL3940933 | 0.87 | KDM4E (0.53) | — |
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 7807 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 |
|---|---|---|---|---|---|---|---|
| CN-121735989-B | Method for catalyzing hydroboration reaction of nitrile compound | WEIFANG UNIVERSITY (CN) | 2026-05-26 | — | — | CN | claimed |
| EP-4743438-A1 | AN IMPROVED PROCESS FOR THE PREPARATION OF BENZONITRILE COMPOUNDS FROM THE BENZOTRICHLORIDE COMPOUNDS | Aarti Industries Limited (IN) | 2026-05-20 | — | — | EP | claimed |
| CN-122051359-A | Polymer electrolyte and contain this sodium ion battery of polymer electrolyte | 浙江钠创新能源有限公司 | 2026-05-15 | — | — | CN | claimed |
| US-12620624-B2 | Non-aqueous electrolytic solution for lithium secondary battery and lithium secondary battery comprising same | LG ENERGY SOLUTION, LTD. (KR) | 2026-05-05 | — | — | US | claimed |
| US-12573655-B2 | Lithium-sulfur secondary battery | LG ENERGY SOLUTION, LTD. (KR) | 2026-03-10 | — | — | US | claimed |
| EP-4322275-B1 | NON-AQUEOUS ELECTROLYTE FOR LITHIUM SECONDARY BATTERY AND LITHIUM SECONDARY BATTERY INCLUDING THE SAME | LG ENERGY SOLUTION LTD (KR) | 2026-02-18 | — | — | EP | claimed |
| EP-4665705-A1 | A PROCESSES FOR THE PREPARATION OF BENZONITRILE COMPOUNDS FROM THE CORRESPONDING BENZOTRICHLORIDE COMPOUNDS | Aarti Industries Limited (IN) | 2025-12-24 | — | — | EP | claimed |
| EP-4632863-A1 | USE OF PYROSULFATE-BORON TRIFLUORIDE COMPOSITE METAL SALT IN ELECTROLYTE SOLUTION, AND PREPARATION METHOD THEREFOR | Zhejiang Lantian Environmental Protection Hi-Tech Co., Ltd. (CN) | 2025-10-15 | — | — | EP | claimed |
| US-12431535-B2 | Non-aqueous electrolyte solution for lithium secondary battery and lithium secondary battery including the same | LG ENERGY SOLUTION, LTD. (KR) | 2025-09-30 | — | — | US | claimed |
| US-20250300224-A1 | Non-Aqueous Electrolyte for Lithium Secondary Battery and Lithium Secondary Battery Including the Same | LG ENERGY SOLUTION, LTD. (KR) | 2025-09-25 | — | — | US | claimed |
| EP-0370332-B1 | N-aryl-nitrogen heterocycles, process and intermediates for their production and their use as herbicides and in controlling the growth of plants | BAYER AG (DE) | 1994-03-30 | — | — | EP | claimed |
| EP-0236940-B1 | ALPHA-HETEROCYCLE SUBSTITUTED TOLUNITRILES | CIBA-GEIGY AG (CH) | 1993-09-22 | — | — | EP | claimed |
| EP-0243000-B1 | POLYCYANOARYL ETHER, METHOD FOR PREPARING THE SAME AND USES THEREOF | IDEMITSU KOSAN COMPANY LIMITED (JP) | 1990-10-03 | — | — | EP | claimed |
| CN-1042902-A | Methods for treating and preventing pneumocystis carinii pneumonia and other diseases, and compounds and formulations used therein | TIDWELL RICHARD R (US) | 1990-06-13 | — | — | CN | claimed |
| EP-0370332-A1 | N-aryl-nitrogen heterocycles, process and intermediates for their production and their use as herbicides and in controlling the growth of plants | BAYER AG (DE) | 1990-05-30 | — | — | EP | claimed |
| US-4822903-A | Fluorinated silica catalyst and preparation of aromatic/aliphatic nitriles in the presence thereof | RHONE-POULENC SPECIALITES CHIMIQUES (FR) | 1989-04-18 | — | — | US | claimed |
| EP-0243000-A1 | Polycyanoaryl ether, method for preparing the same and uses thereof | IDEMITSU KOSAN COMPANY LIMITED (JP) | 1987-10-28 | — | — | EP | claimed |
| EP-0236940-A2 | Alpha-heterocycle substituted tolunitriles | CIBA-GEIGY AG (CH) | 1987-09-16 | — | — | EP | claimed |
| US-4438042-A | FROM AMIDES, FLUORINATE SILCEOUS CATALYSTS | RHONE-POULENC SPECIALITES CHIMIQUES (FR) | 1984-03-20 | — | — | US | claimed |
| US-4436669-A | CYANATION, DECARBONYLATION, ACID CATALYSTS | RHONE-POULENC SPECIALITES CHIMIQUES (FR) | 1984-03-13 | — | — | US | claimed |