Acetonitrile

Acetonitrile

SCHEMBL1483508

CC#N.CC#N.CC#N.CC#N.[Cu]

nearest known ligand 0.33

Full drug profile on Sugi Atlas →

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CA1 P00915 4/20 0.30
CA2 P00918 4/20 0.30
CA5A P35218 1/20 0.30
CA9 Q16790 1/20 0.30
CA5B Q9Y2D0 1/20 0.30

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.

Compoundsimilaritytop predictedshared targets
Acetonitrile SCHEMBL2370865 1.00
Acetonitrile SCHEMBL1148960 1.00
Acetonitrile SCHEMBL7928496 0.94 TSHR (0.31) TSHRALDH1A1
Acetonitrile SCHEMBL11344691 0.94
Acetonitrile SCHEMBL1330624 0.93
Acetonitrile SCHEMBL10523138 0.93
Acetonitrile SCHEMBL6693864 0.93
Acetonitrile SCHEMBL1330705 0.93
Acetonitrile SCHEMBL10524251 0.93 TSHR (0.36) TSHRALDH1A1CA1CA2CA5A
Acetonitrile SCHEMBL10051948 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

Claimed or disclosed in 260 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4746714-A1 ANTIMICROBIAL COMPOSITIONS INCLUDING COPPER(I) SALTS AND ADDITIVES Corning Incorporated (US) 2026-05-27 EP claimed
CN-119569642-A Method for directly decarboxylating and iodizing alkyl carboxylic acid by photo-oxidation reduction/copper co-catalysis 天津科技大学 2025-03-07 CN claimed
WO-2025027140-A1 N-ALKOXYAMINE MARKER AND PROCESSES FMC Agricultural Solutions A/S (DK) 2025-02-06 WO claimed
WO-2025019153-A1 ANTIMICROBIAL COMPOSITIONS INCLUDING COPPER(I) SALTS AND ADDITIVES CORNING INCORPORATED (US) 2025-01-23 WO claimed
CN-119306745-A Copper nanocluster, preparation method and application thereof, hydrogenation catalyst and preparation method of 4-formylmorpholine 中国石油化工股份有限公司 2025-01-14 CN claimed
US-12063933-B1 Antimicrobial compositions including copper(I) salts and additives CORNING INCORPORATED (US) 2024-08-20 US claimed
CN-118307485-A Preparation method of diazabicyclononane and decane 五邑大学 2024-07-09 CN claimed
CN-115572335-B Chitosan-based fluorescent probe for formaldehyde monitoring and preparation method and application thereof 齐鲁工业大学 2024-01-16 CN claimed
CN-116332963-A Copper (I) coordination compound and preparation method and application thereof 苏州大学 2023-06-27 CN claimed
CN-116178432-A Novel preparation method of fosfomycin sodium 鼎元(天津)生物医药科技有限公司 2023-05-30 CN claimed
US-20040204412-A1 Phenylglycine derivatives useful as serine protease inhibitors BRISTOL-MYERS SQUIBB COMPANY 2004-10-14 US claimed
WO-2004072101-A2 PHENYLGLYCINE DERIVATIVES USEFUL AS SERINE PROTEASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2004-08-26 WO claimed
EP-0713513-A4 TRIS(ISONITRILE)COPPER(I) SULFATES FOR PREPARING RADIONUCLIDE COMPLEXES DU PONT MERCK PHARMA (US) 1999-05-19 EP claimed
EP-0713513-A1 TRIS(ISONITRILE)COPPER(I) SULFATES FOR PREPARING RADIONUCLIDE COMPLEXES THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1996-05-29 EP claimed
WO-1995004114-A1 TRIS(ISONITRILE)COPPER(I) SULFATES FOR PREPARING RADIONUCLIDE COMPLEXES THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1995-02-09 WO claimed
EP-0395695-B1 TRIS(ISONITRILE)COPPER(I) ADDUCTS FOR PREPARING RADIONUCLIDE COMPLEXES DU PONT MERCK PHARMA (US) 1995-01-18 EP claimed
EP-0395695-A4 TRIS(ISONITRILE)COPPER(I) ADDUCTS FOR PREPARING RADIONUCLIDE COMPLEXES 1991-04-17 EP claimed
US-5008418-A Reacting cuprous acetonitrile complex or halide in solvent with isonitrile complex or ligand, desolventizing E. I. DU PONT DE NEMOURS AND COMPANY (US) 1991-04-16 US claimed
EP-0395695-A1 TRIS(ISONITRILE)COPPER(I) ADDUCTS FOR PREPARING RADIONUCLIDE COMPLEXES. DU PONT (US) 1990-11-07 EP claimed
WO-1989002433-A1 TRIS(ISONITRILE)COPPER(I) ADDUCTS FOR PREPARING RADIONUCLIDE COMPLEXES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1989-03-23 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040204412-A1 Phenylglycine derivatives useful as serine protease inhibitors F7, SERPINE1, HABP2 TSHR 1647/4885ALDH1A1 3767/4885CA1 2220/4885
US-12063933-B1 Antimicrobial compositions including copper(I) salts and additives SOD1, AOC1, SOD3 TSHR 4375/4885ALDH1A1 309/4885CA1 1992/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.