SCHEMBL29871204

SCHEMBL29871204

C#CC(C#C[Si](C(C)C)(C(C)C)C(C)C)(O[Si](C)(C)C(C)(C)C)c1ccccc1

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CACNA2D1 P54289 1/20 0.31
▸ CACNB2 Q08289 1/20 0.31
▸ CACNA1C Q13936 1/20 0.31

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
SCHEMBL29213024 0.81 CACNA2D1 (0.34) CACNA2D1CACNB2CACNA1C
SCHEMBL29212985 0.70 CACNA2D1 (0.40) CACNA2D1CACNB2CACNA1C
SCHEMBL31252158 0.66 KDM4E (0.47) CACNA2D1CACNB2CACNA1C
SCHEMBL15077772 0.66 CACNA2D1 (0.44) CACNA2D1CACNB2CACNA1C
SCHEMBL29144963 0.65 MAPK1 (0.34) —
SCHEMBL31306987 0.64 ALDH1A1 (0.38) —
SCHEMBL22160044 0.64 MAPK1 (0.43) —
SCHEMBL29213002 0.64 CACNA2D1 (0.40) CACNA2D1CACNB2CACNA1C
SCHEMBL9257656 0.62 MAPK1 (0.40) —
SCHEMBL8996052 0.61 MAPK1 (0.36) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115073401-B 2,3 '-bisfuran compound, 2,3' -oligomeric furan compound, and preparation methods and applications thereof 华南理工大学 2023-07-14 — — CN disclosed
CN-115073401-A 2,3 '-difuran compound and 2,3' -oligofuran compound, and preparation method and application thereof 华南理工大学 2022-09-20 — — CN disclosed
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