SCHEMBL2569768

SCHEMBL2569768

NCCCOCc1ccncc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 4/20 0.52
LOXL2 Q9Y4K0 2/20 0.48
AKT1 P31749 1/20 0.41
DYRK3 O43781 1/20 0.41
ROCK2 O75116 1/20 0.41
PRKD3 O94806 1/20 0.41
MAP4K4 O95819 1/20 0.41
PIM1 P11309 1/20 0.41
PRKACA P17612 1/20 0.41
RPS6KB1 P23443 1/20 0.41
CLK2 P49760 1/20 0.41
PRKX P51817 1/20 0.41
ROCK1 Q13464 1/20 0.41
DYRK1A Q13627 1/20 0.41
PRKG1 Q13976 1/20 0.41
PKN2 Q16513 1/20 0.41
CLK4 Q9HAZ1 1/20 0.41
MKNK2 Q9HBH9 1/20 0.41
STK17A Q9UEE5 1/20 0.41
HRH4 Q9H3N8 2/20 0.38

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
SCHEMBL2569282 0.88 LOXL2 (0.52) HRH1LOXL2AKT1DYRK3ROCK2
SCHEMBL14101264 0.87 LOXL2 (0.42) HRH1LOXL2HRH4HRH3GBA1
SCHEMBL17132267 0.83 LOXL2 (0.46) HRH1LOXL2HRH4HRH3ALDH1A1
SCHEMBL2570882 0.82 HRH1 (0.60) HRH1LOXL2AKT1DYRK3ROCK2
SCHEMBL12743794 0.82 HRH1 (0.48) HRH1LOXL2HRH4HRH3CYP1A2
SCHEMBL12743775 0.80 HRH1 (0.52) HRH1LOXL2HRH4HRH3GBA1
SCHEMBL2782 0.79 TSHR (0.58) LOXL2HRH4HRH3CYP2A6
SCHEMBL8905967 0.78 HRH3 (0.39) LOXL2HRH4HRH3GBA1UGCG
SCHEMBL7552891 0.78 CYP2A6 (0.61) HRH1HRH4HRH3CYP2A6CYP1A2
SCHEMBL492258 0.78 TSHR (0.52) HRH1LOXL2ALDH1A1CYP1A2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2382274-B1 AQUEOUS COATING COMPOSITION COMPRISING PYRIDINE GROUP-CONTAINING ELECTROCOAT RESIN BASF COATINGS GMBH (DE) 2015-04-22 EP disclosed
EP-2382274-A1 PYRIDINE GROUP-CONTAINING ELECTROCOAT RESIN BASF Coatings GmbH (DE) 2011-11-02 EP disclosed
WO-2010077404-A1 PYRIDINE GROUP-CONTAINING ELECTROCOAT RESIN BASF COATINGS GMBH (US) 2010-07-08 WO disclosed
US-20100167069-A1 PYRIDINE GROUP-CONTAINING ELECTROCOAT RESIN BASF CORPORATION (US) 2010-07-01 US disclosed
US-20100167071-A1 PYRIDINE GROUP-CONTAINING ELECTROCOAT COMPOSITION WITH METAL OXIDE BASF CORPORATION (US) 2010-07-01 US disclosed