SCHEMBL7686324

SCHEMBL7686324

C=CCN(C)CCCCCCOc1ccc(C(=O)c2ccc(Br)cc2)c(N(C)C)c1

nearest known ligand 0.80

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
LSS P48449 20/20 0.80
MEN1 O00255 1/20 0.79
KMT2A Q03164 1/20 0.79

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
Hydrochloric Acid SCHEMBL7679094 0.99 LSS (0.79) LSSMEN1KMT2A
SCHEMBL8760725 0.89 LSS (0.79) LSSMEN1KMT2A
SCHEMBL7679409 0.89 LSS (1.00) LSSMEN1KMT2A
SCHEMBL7681230 0.88 LSS (0.80) LSSMEN1KMT2A
SCHEMBL3674881 0.88 LSS (1.00) LSSMEN1KMT2A
Bromide SCHEMBL7685880 0.87 LSS (0.98) LSSMEN1KMT2A
SCHEMBL7677258 0.87 LSS (1.00) LSSMEN1KMT2A
SCHEMBL7685455 0.87 LSS (1.00) LSSMEN1KMT2A
SCHEMBL7687712 0.87 LSS (1.00) LSSMEN1KMT2A
SCHEMBL2131185 0.86 LSS (1.00) 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6441177-B1 Tertiary amines HOFFMANN-LA ROCHE INC. 2002-08-27 US claimed
EP-0778264-B1 Tertiary amines having antimycotic and cholesterol lowering activity HOFFMANN LA ROCHE (CH) 2001-07-11 EP claimed
EP-0778264-A1 Tertiary amines having antimycotic and cholesterol lowering activity F. HOFFMANN-LA ROCHE AG (CH) 1997-06-11 EP claimed
US-6441177-B1 Tertiary amines HOFFMANN-LA ROCHE INC. 2002-08-27 US disclosed
EP-0778264-B1 Tertiary amines having antimycotic and cholesterol lowering activity HOFFMANN LA ROCHE (CH) 2001-07-11 EP disclosed
US-6034275-A FUGICIDES; ATICHOLESTEROL AGENTS HOFFMANN-LA ROCHE INC. (US) 2000-03-07 US disclosed
EP-0778264-A1 Tertiary amines having antimycotic and cholesterol lowering activity F. HOFFMANN-LA ROCHE AG (CH) 1997-06-11 EP disclosed