SCHEMBL7084848

SCHEMBL7084848

C=CC1COC(CO)(CO)O1

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.37
KDM4E B2RXH2 2/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
PKM P14618 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
SCHEMBL459990 0.81 TDP1 (0.39) TDP1
SCHEMBL9130929 0.79 TDP1 (0.37) TDP1
SCHEMBL13822372 0.79 TDP1 (0.37) TDP1
SCHEMBL9131612 0.71 TDP1 (0.30) TDP1
SCHEMBL13392802 0.70 TDP1 (0.46) TDP1
SCHEMBL9391499 0.70 TSHR (0.31)
SCHEMBL4912736 0.69 TDP1 (0.36) TDP1
SCHEMBL13822519 0.69
SCHEMBL6691952 0.68 TDP1 (0.30) TDP1
SCHEMBL7086407 0.67 KDM4E (0.36) KDM4EPKM

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
US-20030108495-A1 Cosmetic compositions containing 2,2-dihydroxymethy1-1,3-dioxolanes STROUD ERIC MATTHEW (US) 2003-06-12 US disclosed