Known targets — ChEMBL curated mechanism
ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA
The experimentally established mechanism targets of Benzonitrile. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.88 |
| ▸ | MAOB | P27338 | 4/20 | 0.54 |
| ▸ | MAOA | P21397 | 3/20 | 0.54 |
| ▸ | APP | P05067 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CA3 | P07451 | 1/20 | 0.46 |
| ▸ | CA6 | P23280 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.42 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.41 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.41 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.40 |
| ▸ | MMP3 | P08254 | 1/20 | 0.40 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
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 | |
|---|---|---|---|---|
| Benzonitrile SCHEMBL3159982 | 1.00 | TSHR (0.88) | TSHRMAOBMAOAAPPALDH1A1 | |
| Benzonitrile SCHEMBL5605359 | 1.00 | TSHR (0.88) | TSHRMAOBMAOAAPPALDH1A1 | |
| Benzonitrile SCHEMBL10689627 | 0.94 | TSHR (0.88) | TSHRMAOBMAOAAPPALDH1A1 | |
| Benzonitrile SCHEMBL3473848 | 0.94 | TSHR (0.88) | TSHRMAOBMAOAAPPALDH1A1 | |
| Benzonitrile SCHEMBL27748096 | 0.94 | TSHR (0.88) | TSHRMAOBMAOAAPPALDH1A1 | |
| Benzonitrile SCHEMBL9438699 | 0.94 | TSHR (0.88) | TSHRMAOBMAOAAPPALDH1A1 | |
| Benzonitrile SCHEMBL5376660 | 0.94 | TSHR (0.88) | TSHRMAOBMAOAAPPALDH1A1 | |
| Benzonitrile SCHEMBL10952597 | 0.94 | TSHR (0.88) | TSHRMAOBMAOAAPPALDH1A1 | |
| Benzonitrile SCHEMBL8713536 | 0.94 | TSHR (0.88) | TSHRMAOBMAOAAPPALDH1A1 | |
| Benzonitrile SCHEMBL242251 | 0.94 | TSHR (0.88) | TSHRMAOBMAOAAPPALDH1A1 |
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 2110 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-122036738-A | Chiral indolone spirochroman compound, and synthetic method and application thereof | 成都大学 | 2026-05-15 | — | — | CN | claimed |
| EP-4725945-A1 | PREPARATION METHOD FOR FORMAMIDE COMPOUNDS | Shanghai Senhui Medicine Co., Ltd. (CN) | 2026-04-15 | — | — | EP | claimed |
| CN-120192545-A | Metal main chain macromolecule based on triazine compound and synthetic method thereof | 复旦大学 | 2025-06-24 | — | — | CN | claimed |
| EP-4568924-A2 | METHOD OF SYNTHESIZING COVALENTLY BONDED LATTICES | CASE WESTERN RESERVE UNIVERSITY (US) | 2025-06-18 | — | — | EP | claimed |
| CN-120025304-A | Method for preparing cyclic ether based on propargyl compound | 南京师范大学 | 2025-05-23 | — | — | CN | claimed |
| US-20250136539-A1 | ESTERS OF 5-METHYLHEX-2-ENOL AND THEIR USE AS AROMA CHEMICALS | BASF SE (DE) | 2025-05-01 | — | — | US | claimed |
| US-12275752-B2 | Class of phosphine nitrogen ligand with multiple chiral centers and its synthesis method and application | SHANGHAI INSTITUTE OF ORGANIC CHEMISTRY, CHINESE ACADEMY OF SCIENCES (CN) | 2025-04-15 | — | — | US | claimed |
| US-12258360-B2 | Compositions and methods for treatment of anticancer-drug resistant cancers | THE GEORGE WASHINGTON UNIVERSITY (US) | 2025-03-25 | — | — | US | claimed |
| CN-119570010-A | Polyethylene glycol-poly (2-vinyl) ethylene glycol copolymer and preparation method thereof | 绍兴新迈特新材料有限公司 | 2025-03-07 | — | — | CN | claimed |
| CN-119529260-A | Polycaprolactone-poly (2-vinyl) ethylene glycol copolymer and preparation method thereof | 上海交通大学 | 2025-02-28 | — | — | CN | claimed |
| US-4709054-A | REACTION OF AROMATIC ACYL HALIDE AND HALOGENATED POLYSILANE, TRANSITION METAL CATALYST | GENERAL ELECTRIC COMPANY (US) | 1987-11-24 | — | — | US | claimed |
| EP-0043485-B1 | METHOD OF ACTIVATING SURFACES FOR ELECTROLESS PLATING | BAYER AG (DE) | 1985-05-15 | — | — | EP | claimed |
| US-4386217-A | LESS PALLADIUM REQUIRED | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1983-05-31 | — | — | US | claimed |
| US-4368281-A | Printed circuits | AMP INCORPORATED (US) | 1983-01-11 | — | — | US | claimed |
| US-4322562-A | FOR OXIDATION OF OLEFINS | ALLIED CORPORATION (US) | 1982-03-30 | — | — | US | claimed |
| US-4260750-A | OF DIENES, TRIARYLPHOSPHINE CATALYST | RHONE-POULENC INDUSTRIES (FR) | 1981-04-07 | — | — | US | claimed |
| US-4221920-A | Aromatic salicylate process | GENERAL ELECTRIC COMPANY (US) | 1980-09-09 | — | — | US | claimed |
| US-4219677-A | FOR DIENES IN PRESENCE OF SULFONATED PHOSPHINE CATALYST | RHONE-POULENC INDUSTRIES (FR) | 1980-08-26 | — | — | US | claimed |
| US-4142060-A | DIENES, WATER | RHONE-POULENC INDUSTRIES (FR) | 1979-02-27 | — | — | US | claimed |
| US-4006047-A | Catalysts for electroless deposition of metals on comparatively low-temperature polyolefin and polyester substrates | AMP INCORPORATED (US) | 1977-02-01 | — | — | US | claimed |