SCHEMBL31497780

SCHEMBL31497780

C[Si](C)(C)OC1CC2CCCC(C1)N2

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
CHRM2 P08172 3/20 0.34
CHRM4 P08173 3/20 0.34
CHRM3 P20309 3/20 0.34
CHRM1 P11229 2/20 0.34
SLC6A4 P31645 8/20 0.33
SLC6A2 P23975 5/20 0.33
SLC6A3 Q01959 5/20 0.33

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
SCHEMBL55889 0.72
SCHEMBL14523283 0.72
SCHEMBL31352356 0.71 SLC6A4 (0.35) SLC6A4SLC6A2SLC6A3
Hydrochloric Acid SCHEMBL25395133 0.69
SCHEMBL7941245 0.68 ACHE (0.30)
SCHEMBL8788188 0.67
SCHEMBL4704711 0.67 CHRM2 (0.61) KDM4EALDH1A1CHRM2CHRM4CHRM3
SCHEMBL31497774 0.67
SCHEMBL1829357 0.66
SCHEMBL8237149 0.66 KDM4E (0.45) KDM4EALDH1A1CHRM2CHRM4CHRM3

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
WO-2025095021-A1 TETRAZENE COMPOUND, TETRAZENE RADICAL SALT COMPOUND, TETRAZENE-TYPE ALCOHOL OXIDATION CATALYST, TETRAZENE RADICAL SALT-TYPE ALCOHOL OXIDATION CATALYST, AND ALCOHOL OXIDATION METHOD USING SAME 国立大学法人東北大学 2025-05-08 WO disclosed