SCHEMBL9744623

SCHEMBL9744623

CCCCCCCCCCCCC(c1coc([Si](C)(C)C)c1)S(C)(=O)=O

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.34
NR1I2 O75469 1/20 0.33
TP53 P04637 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
SCHEMBL9326410 0.80 CA2 (0.32) CA2NR1I2
SCHEMBL7301168 0.78 CA2 (0.40) CA2TP53
SCHEMBL7303995 0.78 CA2 (0.40) CA2TP53
SCHEMBL9744900 0.74
SCHEMBL9747045 0.72
SCHEMBL7303252 0.72 ALDH2 (0.37)
SCHEMBL9325034 0.72 GLS2 (0.35)
SCHEMBL9766908 0.70 ZDHHC7 (0.43) CA2
SCHEMBL9325309 0.70 LMNA (0.42)
SCHEMBL9746369 0.69 ALDH2 (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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5089485-A ANTI-INFLAMMATORY FURANONES ALLERGAN, INC. (US) 1992-02-18 US disclosed
EP-0369811-A2 Anti-inflammatory furanones ALLERGAN, INC (US) 1990-05-23 EP disclosed