SCHEMBL4192027

SCHEMBL4192027

Cc1cc2c(c(Br)c1C)C(=O)C(C)C2

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ACHE P22303 16/20 0.44
BACE1 P56817 1/20 0.38
CYP1A2 P05177 1/20 0.33
MAOA P21397 1/20 0.31
MEN1 O00255 1/20 0.30
MAPT P10636 1/20 0.30
KMT2A Q03164 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL7581528 0.84 ACHE (0.47) ACHEBACE1MEN1MAPTKMT2A
SCHEMBL2484777 0.77 ACHE (0.49) ACHEMAOA
SCHEMBL4202516 0.77 ACHE (0.45) ACHEBACE1MAOA
SCHEMBL4197678 0.74 ACHE (0.46) ACHEBACE1MAOA
SCHEMBL5716849 0.73 ACHE (0.49) ACHEBACE1
SCHEMBL3661432 0.72 ACHE (0.49) ACHECYP1A2MAOA
SCHEMBL5952663 0.71 ACHE (0.46) ACHE
SCHEMBL29507295 0.71 ACHE (0.53) ACHEBACE1
SCHEMBL16489153 0.71 ACHE (0.53) ACHEBACE1MAOA
SCHEMBL5952853 0.70 ACHE (0.45) ACHE

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-1636245-B1 BISINDENYL ZIRCONIUM COMPLEXES FOR USE IN THE POLYMERISATION OF OLEFINS BASELL POLYOLEFINE GMBH (DE) 2009-02-25 EP disclosed
US-20060252637-A1 Bisindenyl zirconium complexes for use in the polymerization of olefins BASELL POLYOLEFINE GMBH (DE) 2006-11-09 US disclosed
EP-1636245-A1 BISINDENYL ZIRCONIUM COMPLEXES FOR USE IN THE POLYMERISATION OF OLEFINS Basell Polyolefine GmbH (DE) 2006-03-22 EP disclosed
WO-2004106351-A1 BISINDENYL ZIRCONIUM COMPLEXES FOR USE IN THE POLYMERISATION OF OLEFINS BASELL POLYOLEFINE GMBH (DE) 2004-12-09 WO disclosed