SCHEMBL9543281

SCHEMBL9543281

CCN(CC1CCCO1)CC1COC2(CCC(C(C)(C)C)CC2)O1

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
PABPC1 P11940 1/20 0.30
CTDSP1 Q9GZU7 1/20 0.30
GAA P10253 1/20 0.30

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
Spiroxamine SCHEMBL20282 0.84 PABPC1 (0.31) PABPC1CTDSP1
Spiroxamine SCHEMBL17335924 0.84 PABPC1 (0.31) PABPC1CTDSP1
Spiroxamine SCHEMBL27795318 0.83 PABPC1 (0.30) PABPC1CTDSP1
SCHEMBL9539652 0.81 ALDH1A1 (0.32) ALDH1A1LMNAMAPT
SCHEMBL9543293 0.79
SCHEMBL12532487 0.78 PABPC1 (0.32) PABPC1CTDSP1GAA
Spiroxamine SCHEMBL303050 0.78
SCHEMBL8527748 0.76 PABPC1 (0.37) PABPC1CTDSP1GAA
SCHEMBL19088354 0.74 ADRA1A (0.32) PABPC1CTDSP1
SCHEMBL9203504 0.73 PABPC1 (0.36) PABPC1CTDSP1GAA

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-1993002074-A1 ALKOXYAMINO KETALS, THEIR PREPARATION AND INTERMEDIATE PRODUCTS THEREFOR, AND THEIR USE AS FUNGICIDES CHEMINOVA AGRO A/S (DK) 1993-02-04 WO disclosed