SCHEMBL8045882

SCHEMBL8045882

C=CCN(C)CCCCCCOc1ccc(C(=O)c2ccc(Br)cc2)cc1Br

nearest known ligand 0.74

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
LSS P48449 20/20 0.74
MEN1 O00255 1/20 0.63
KMT2A Q03164 1/20 0.63

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
SCHEMBL3679175 0.90 LSS (0.72) LSSMEN1KMT2A
SCHEMBL3682279 0.90 LSS (0.72) LSSMEN1KMT2A
SCHEMBL2131185 0.85 LSS (1.00) LSSMEN1KMT2A
SCHEMBL3811386 0.85 LSS (1.00) LSSMEN1KMT2A
Bromide SCHEMBL8048776 0.84 LSS (0.98) LSSMEN1KMT2A
SCHEMBL3671762 0.84 LSS (0.98) LSSMEN1KMT2A
Bromide SCHEMBL8047816 0.83 LSS (0.95) LSSMEN1KMT2A
SCHEMBL7687928 0.83 LSS (1.00) LSSMEN1KMT2A
SCHEMBL3669369 0.82 LSS (0.74) LSSMEN1KMT2A
SCHEMBL3669371 0.82 LSS (0.74) 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
EP-0636367-B1 Use of phenylalkylamines for producing cholesterol lowering agents HOFFMANN LA ROCHE (CH) 2000-03-29 EP claimed
EP-0636367-A1 Use of phenylalkylamines for producing cholesterol lowering agents F. HOFFMANN-LA ROCHE AG (CH) 1995-02-01 EP claimed
EP-0636367-B1 Use of phenylalkylamines for producing cholesterol lowering agents HOFFMANN LA ROCHE (CH) 2000-03-29 EP disclosed
US-5637771-A Compound useful for lowering cholesterol HOFFMANN-LA ROCHE INC. (US) 1997-06-10 US disclosed
US-5574071-A ADMINISTERING PHENYLALKYLAMINO KETONES HOFFMANN-LA ROCHE INC. (US) 1996-11-12 US disclosed
US-5495048-A ANTICHOLESTEROL AGENTS HOFFMANN-LA ROCHE INC. (US) 1996-02-27 US disclosed
EP-0636367-A1 Use of phenylalkylamines for producing cholesterol lowering agents F. HOFFMANN-LA ROCHE AG (CH) 1995-02-01 EP disclosed