SCHEMBL1123322

SCHEMBL1123322

C#CCC(CC(I)CCC)NC(=O)O

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 2/20 0.30
GRIK2 Q13002 2/20 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
SCHEMBL9386582 0.86
SCHEMBL8961048 0.83 TAS1R3 (0.37) GRIK1GRIK2
SCHEMBL464865 0.80 GRIK1 (0.33) GRIK1GRIK2
SCHEMBL26965381 0.76 ALDH1A1 (0.37) GRIK1GRIK2
SCHEMBL27122527 0.76 ALDH1A1 (0.37) GRIK1GRIK2
SCHEMBL1123550 0.73 GRIK1 (0.32) GRIK1GRIK2
SCHEMBL16967902 0.70 GRIK1 (0.34) GRIK1GRIK2
SCHEMBL5133204 0.69 TAS1R3 (0.50)
SCHEMBL8463148 0.68
SCHEMBL1252431 0.67 CHRM1 (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160360753-A1 BIOCIDIC MICROCAPSULES LANXESS DEUTSCHLAND GMBH (DE) 2016-12-15 US claimed
US-7083801-B2 Stabilized haloalkynyl microbicide compositions ROHM AND HAAS COMPANY 2006-08-01 US claimed
EP-1382248-B1 Stabilized haloalkynyl microbicide compositions ROHM & HAAS (US) 2005-10-05 EP claimed
US-20040014736-A1 Stabililzed haloalkynyl microbicide compositions ROHM AND HAAS COMPANY 2004-01-22 US claimed
EP-1382248-A1 Stabilized haloalkynyl microbicide compositions ROHM AND HAAS COMPANY (US) 2004-01-21 EP claimed
EP-1164850-B1 AQUEOUS FUNGICIDE DISPERSION AVECIA LTD (GB) 2003-06-25 EP claimed
US-6506794-B1 An aqueous dispersion comprising a halopropargyl compound and a partially hydrolysed polyvinyl alcohol. The aqueous dispersions are useful for inhibiting the growth of micro-organisms on or in a medium, especially an industrial AVECIA INC. 2003-01-14 US claimed
EP-1164850-A1 AQUEOUS FUNGICIDE DISPERSION Avecia Limited (GB) 2002-01-02 EP claimed
WO-2000057702-A1 AQUEOUS FUNGICIDE DISPERSION AVECIA LIMITED (GB) 2000-10-05 WO claimed
JP-2231404-A None JP disclosed
CN-118984825-A Novel cooling agent and preparation containing same 西姆莱斯股份公司 2024-11-19 CN disclosed
WO-2024204512-A1 FUNCTIONAL PARTICLE DISPERSION 三菱鉛筆株式会社 2024-10-03 WO disclosed
CN-114555720-B Antifouling additive 阿萨达股份公司 2024-04-05 CN disclosed
WO-2023078794-A1 BIOCIDAL POLYMER BLEND LANXESS DEUTSCHLAND GMBH (DE) 2023-05-11 WO disclosed
EP-1164850-A1 AQUEOUS FUNGICIDE DISPERSION Avecia Limited (GB) 2002-01-02 EP disclosed
US-6211218-B1 DIMETHYLALKYLAMINE, ALIPHATIC DICARBOXYLIC ACID, TRIAZOLE COMPOUNDS AND WATER INSOLUBLE MONOCARBOXYLIC ACID BASF AKTIENGESELLSCHAFT (DE) 2001-04-03 US disclosed
WO-2000069265-A1 MICROBICIDAL COMPOSITION OF A 2-ALKYLBENZISOTHIAZOL-3-ONE AND A HALOPROPYNYL COMPOUND AVECIA LIMITED (GB) 2000-11-23 WO disclosed
WO-2000057702-A1 AQUEOUS FUNGICIDE DISPERSION AVECIA LIMITED (GB) 2000-10-05 WO disclosed
US-5880143-A CONSISTING OF DIMETHYLALKYLAMINO, ALIPHATIC DICARBOXYLIC ACID AND A TRIAZOLE BASF AKTIENGESELLSCHAFT (DE) 1999-03-09 US disclosed
JP-H02231404-A WOOD PRESERVATIVE AND SOIL-TREATING AGENT TROY CHEM CORP 1990-09-13 JP disclosed

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

For each of this compound's patents that has machine-readable text (1 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-20040014736-A1 Stabililzed haloalkynyl microbicide compositions MGLL, HDHD5, SLC39A14 GRIK1 3983/4885GRIK2 3897/4885

“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.