SCHEMBL8743545

SCHEMBL8743545

OCCC(F)(F)COC1CCCCO1

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.32
KDM4C Q9H3R0 1/20 0.32

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
SCHEMBL20120334 0.90 KMT2A (0.36) MEN1KMT2AL3MBTL1KDM4C
SCHEMBL20213991 0.90 KMT2A (0.36) MEN1KMT2AL3MBTL1KDM4C
SCHEMBL9156540 0.86 MEN1 (0.37) MEN1KMT2AL3MBTL1KDM4C
SCHEMBL17678845 0.79 MEN1 (0.34) MEN1KMT2AL3MBTL1KDM4C
SCHEMBL8572408 0.78 MEN1 (0.37) MEN1KMT2AL3MBTL1KDM4C
SCHEMBL20120633 0.77 MEN1 (0.35) MEN1KMT2A
SCHEMBL30679074 0.77 MEN1 (0.41) MEN1KMT2AL3MBTL1KDM4C
SCHEMBL22436681 0.77 MEN1 (0.41) MEN1KMT2AL3MBTL1KDM4C
SCHEMBL27098751 0.76 MEN1 (0.33) MEN1KMT2AL3MBTL1KDM4C
SCHEMBL20120528 0.76 MEN1 (0.37) MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0335770-B1 Novel fluorophosphonate nucleotide derivatives MERRELL PHARMA INC (US) 1997-01-15 EP disclosed
EP-0339161-A1 Novel fluorophosphonate nucleotide derivatives MERRELL DOW PHARMACEUTICALS INC. (US) 1989-11-02 EP disclosed
EP-0335770-A2 Novel fluorophosphonate nucleotide derivatives MERRELL PHARMACEUTICALS INC. (US) 1989-10-04 EP disclosed