SCHEMBL28636268

SCHEMBL28636268

[CH2]CNC(=O)OCCCCCCCCOC(=O)NCCC[Si](OC)(OC)OC

nearest known ligand 0.54

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ACHE P22303 14/20 0.54
EPHX2 P34913 2/20 0.40
EPHX1 P07099 1/20 0.38

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
SCHEMBL28864995 0.93 ACHE (0.50) ACHEEPHX2
SCHEMBL28925138 0.90 ACHE (0.47) ACHE
SCHEMBL9452192 0.87 ACHE (0.55) ACHEEPHX2EPHX1
SCHEMBL30763457 0.86 ACHE (0.70) ACHEEPHX2EPHX1
SCHEMBL9452185 0.85 ACHE (0.58) ACHEEPHX2EPHX1
SCHEMBL13978949 0.85 ACHE (0.60) ACHEEPHX1
SCHEMBL30936751 0.84 ACHE (0.50) ACHEEPHX2
SCHEMBL28864990 0.83 ACHE (0.44) ACHE
SCHEMBL21404695 0.83 ACHE (0.49) ACHEEPHX2
SCHEMBL31337499 0.82 ACHE (0.51) ACHEEPHX2

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
CN-113491636-A Dental composition characterized by index of amount of silane coupling agent blended 株式会社松风 2021-10-12 CN disclosed