SCHEMBL9323872

SCHEMBL9323872

CC(C)CCCCOCCCCCCBr

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.39
▸ RARB P10826 1/20 0.34
▸ MEN1 O00255 1/20 0.31
▸ THRB P10828 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ MAPT P10636 1/20 0.31

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
SCHEMBL11734794 0.91 ALDH1A1 (0.33) MEN1THRBHTTKMT2AMAPT
SCHEMBL11732736 0.91 ALDH1A1 (0.33) MEN1THRBHTTKMT2AMAPT
SCHEMBL11736517 0.88 ALDH1A1 (0.34) MAPT
SCHEMBL11584374 0.88 ALDH1A1 (0.34) MAPT
SCHEMBL23666631 0.88 LMNA (0.48) LMNARARBMEN1THRBHTT
SCHEMBL8011379 0.88 LMNA (0.48) LMNARARBMEN1THRBHTT
SCHEMBL10498087 0.88 LMNA (0.48) LMNARARBMEN1THRBHTT
SCHEMBL3715852 0.88 LMNA (0.48) LMNARARBMEN1THRBHTT
SCHEMBL1925735 0.88 LMNA (0.48) LMNARARBMEN1THRBHTT
SCHEMBL398667 0.88 LMNA (0.48) LMNARARBMEN1THRBHTT

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-0401966-B1 Phenethanolamine derivatives, processes for their preparation and pharmaceutical compositions containing them GLAXO GROUP LTD (GB) 1994-01-19 — — EP disclosed
US-5066678-A PHENETHANDAMINE DERIVATIVES AND PHARMACEUTICAL USE THEREOF GLAXO GROUP LIMITED (GB) 1991-11-19 — — US disclosed
EP-0401966-A1 Phenethanolamine derivatives, processes for their preparation and pharmaceutical compositions containing them GLAXO GROUP LIMITED (GB) 1990-12-12 — — EP disclosed
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