SCHEMBL21627337

SCHEMBL21627337

N#CCCC(Br)(C#N)CBr.N#CCCCC#N

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.32

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
SCHEMBL154866 0.93 ALDH1A1 (0.33)
Water SCHEMBL18694754 0.93 ALDH1A1 (0.33)
SCHEMBL29349966 0.93 ALDH1A1 (0.33)
SCHEMBL28844645 0.88 TSHR (0.52) TSHR
SCHEMBL8942424 0.83
SCHEMBL9221281 0.80 TSHR (0.57) TSHR
SCHEMBL28114593 0.79 TSHR (0.32) TSHR
Formic Acid Methyl Ester SCHEMBL28270040 0.77 CASP1 (0.33)
SCHEMBL8158066 0.77 ALDH1A1 (0.32)
SCHEMBL6885872 0.76 MEN1 (0.31)

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11571376-B2 Aqueous antimicrobial composition ARXADA AG (CH) 2023-02-07 US disclosed
EP-3840574-A1 COLOR STABLE PRESERVATIVE COMPOSITION LONZA, LLC (US) 2021-06-30 EP disclosed
US-20210106512-A1 Aqueous Antimicrobial Composition Arxada Switzerland AG (CH) 2021-04-15 US disclosed
US-20200100995-A1 Color Stable Preservative Composition Arxada, LLC 2020-04-02 US disclosed
WO-2020069178-A1 COLOR STABLE PRESERVATIVE COMPOSITION LONZA INC. (US) 2020-04-02 WO disclosed
EP-3598897-A1 WATER-SOLUBLE ANTIBACTERIAL COMPOSITION Lonza Ltd (CH) 2020-01-29 EP disclosed