SCHEMBL9364394

SCHEMBL9364394

C=CCN(C)CCCCCCOc1ccc(C(=O)c2ccccc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
LSS P48449 20/20 1.00
MEN1 O00255 1/20 0.61
KMT2A Q03164 1/20 0.61

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
SCHEMBL3816721 0.89 LSS (0.80) LSSMEN1KMT2A
SCHEMBL9360507 0.89 LSS (1.00) LSSMEN1KMT2A
SCHEMBL2131185 0.89 LSS (1.00) LSSMEN1KMT2A
SCHEMBL3811386 0.89 LSS (1.00) LSSMEN1KMT2A
Bromide SCHEMBL8048776 0.88 LSS (0.98) LSSMEN1KMT2A
SCHEMBL3671762 0.88 LSS (0.98) LSSMEN1KMT2A
Bromide SCHEMBL8047816 0.87 LSS (0.95) LSSMEN1KMT2A
SCHEMBL9359996 0.86 LSS (0.76) LSSMEN1KMT2A
SCHEMBL9360203 0.86 LSS (0.76) LSSMEN1KMT2A
SCHEMBL9360197 0.86 LSS (0.76) LSSMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0410359-B1 Substituted aminoalkoxy-benzene-derivatives HOFFMANN LA ROCHE (CH) 1994-01-26 EP disclosed
US-5214046-A Synergistic mixtures, inhibitors of sterol biosynthesis HOFFMANN-LA ROCHE INC. (US) 1993-05-25 US disclosed
US-5106878-A Synergistic effects with other fungicides HOFFMANN-LA ROCHE INC. (US) 1992-04-21 US disclosed
EP-0410359-A1 Substituted aminoalkoxy-benzene-derivatives F. HOFFMANN-LA ROCHE AG (CH) 1991-01-30 EP disclosed