SCHEMBL9749043

SCHEMBL9749043

CCC1COC2(CCC(C(C)(C)C(C)C)CC2)O1

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PABPC1 P11940 1/20 0.34
CTDSP1 Q9GZU7 1/20 0.34
GAA P10253 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
SCHEMBL9542286 0.85 PABPC1 (0.31) PABPC1CTDSP1
SCHEMBL8527748 0.83 PABPC1 (0.37) PABPC1CTDSP1GAA
SCHEMBL9741801 0.78 HTR1A (0.30)
SCHEMBL9539652 0.75 ALDH1A1 (0.32)
SCHEMBL9678068 0.75 PABPC1 (0.32) PABPC1CTDSP1
SCHEMBL9742953 0.74 GAA (0.34) GAA
SCHEMBL11170793 0.74 ALDH1A1 (0.33) PABPC1CTDSP1GAA
SCHEMBL9743283 0.73 KDM4E (0.36) PABPC1CTDSP1
SCHEMBL11403296 0.72 ALDH1A1 (0.42) PABPC1CTDSP1
SCHEMBL13381097 0.72 PABPC1 (0.51) 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-1992016518-A1 AMINOETHYL KETALS, THEIR PREPARATION AND INTERMEDIATE PRODUCTS THEREFOR, AND THEIR USE AS FUNGICIDES CHEMINOVA AGRO A/S (DK) 1992-10-01 WO disclosed