SCHEMBL9834573

SCHEMBL9834573

CCOC(=O)C1C[CH][CH]CC1

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.44
ALDH1A1 P00352 4/20 0.41
KMT2A Q03164 3/20 0.40
PKM P14618 1/20 0.40
MEN1 O00255 2/20 0.39
KDM4E B2RXH2 1/20 0.39
HSD11B1 P28845 1/20 0.39

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
SCHEMBL2539787 0.85 MAPT (0.46) MAPTALDH1A1KMT2AMEN1KDM4E
SCHEMBL29084231 0.81 MAPT (0.44) MAPTALDH1A1KMT2AMEN1KDM4E
SCHEMBL472121 0.81 MAPT (0.44) MAPTALDH1A1KMT2AMEN1KDM4E
SCHEMBL25648750 0.81 MAPT (0.44) MAPTALDH1A1KMT2AMEN1KDM4E
SCHEMBL11680934 0.80 MAPT (0.42) MAPTALDH1A1KMT2AMEN1KDM4E
SCHEMBL11747683 0.80 MAPT (0.42) MAPTALDH1A1KMT2AMEN1KDM4E
SCHEMBL11680930 0.80 MAPT (0.42) MAPTALDH1A1KMT2AMEN1KDM4E
SCHEMBL1414061 0.79 MAPT (0.51) MAPTALDH1A1KMT2AMEN1KDM4E
SCHEMBL34475901 0.79 MAPT (0.51) MAPTALDH1A1KMT2AMEN1KDM4E
SCHEMBL17871025 0.76 ALDH1A1 (0.47) MAPTALDH1A1KMT2AMEN1KDM4E

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0219154-B1 FURYL COMPOUNDS, THEIR USE AS FUNGICIDES AND THEIR PREPARATION SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1991-11-13 EP disclosed
EP-0219154-A2 Furyl compounds, their use as fungicides and their preparation SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1987-04-22 EP disclosed