SCHEMBL9539643

SCHEMBL9539643

CC(C)(C)C1=CCC2(CC1)OCC(CCO)O2

nearest known ligand 0.30

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PABPC1 P11940 1/20 0.30
CTDSP1 Q9GZU7 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL9540602 0.87 PABPC1 (0.30) PABPC1CTDSP1
SCHEMBL9540543 0.80
SCHEMBL9540548 0.74
SCHEMBL12929962 0.70
SCHEMBL9742001 0.69 PABPC1 (0.34) PABPC1CTDSP1
SCHEMBL8637708 0.67 GAA (0.50) PABPC1CTDSP1
SCHEMBL11449640 0.62
SCHEMBL11546036 0.61 PPARG (0.38)
SCHEMBL11467618 0.61
SCHEMBL418942 0.61 CA2 (0.44)

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