SCHEMBL30578239

SCHEMBL30578239

C=Cc1ccc(C[n+]2cc[nH]c2)cc1.C=Cc1ccc(S(=O)(=O)[O-])cc1

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 1/20 0.38
▸ CA1 P00915 2/20 0.32
▸ CA2 P00918 2/20 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
Benzylimidazole SCHEMBL30578260 0.94 CA1 (0.36) TDP1CA1CA2
Sulfuric Acid SCHEMBL30240036 0.93 TDP1 (0.38) TDP1CA1CA2
Sulfuric Acid SCHEMBL30071055 0.92 TDP1 (0.44) TDP1CA1CA2
SCHEMBL23301461 0.89 ALDH1A1 (0.38) CA1CA2
Bromide SCHEMBL30070960 0.87 ALDH1A1 (0.37) CA1CA2
Hydrochloric Acid SCHEMBL23301430 0.87 CA1 (0.39) CA1CA2
Iodide SCHEMBL30071069 0.87 ALDH1A1 (0.37) CA1CA2
Acetic Acid SCHEMBL23301130 0.84 CA1 (0.34) TDP1CA1CA2
SCHEMBL25391098 0.77 TDP1 (0.42) TDP1
1-Methylimidazole SCHEMBL30578266 0.77 TDP1 (0.42) TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4245816-A1 POLYMERISABLE ADDITIVES AND COMPOSITIONS CONTAINING THEM Hochschule Niederrhein (DE) 2023-09-20 — — EP disclosed
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