SCHEMBL5564575

SCHEMBL5564575

COc1ccc(C(=O)C(CCCc2ccccc2)N(C)C)cc1OC

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.53
RAB9A P51151 2/20 0.53
KMT2A Q03164 2/20 0.53
LMNA P02545 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
PDE4A P27815 6/20 0.53
PDE4B Q07343 6/20 0.53
PDE4C Q08493 6/20 0.53
PDE4D Q08499 6/20 0.53
BCHE P06276 3/20 0.52
ACHE P22303 3/20 0.52
MEN1 O00255 1/20 0.49
LPAR1 Q92633 2/20 0.48
ALDH1A1 P00352 1/20 0.47
MAPT P10636 1/20 0.47

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
SCHEMBL6155139 0.78 TSHR (0.53) KMT2ALMNABCHEACHEMEN1
SCHEMBL11689006 0.76 NPC1 (0.59) NPC1RAB9AKMT2ALMNAL3MBTL1
SCHEMBL13754164 0.75 NPC1 (0.57) NPC1RAB9AKMT2ALMNAL3MBTL1
SCHEMBL6819817 0.75 KMT2A (0.62) NPC1RAB9AKMT2ALMNAL3MBTL1
SCHEMBL25218779 0.74 ACHE (0.56) NPC1RAB9ALMNAL3MBTL1BCHE
Vetrabutine SCHEMBL555056 0.74 EBP (0.45) NPC1RAB9AKMT2ALMNAL3MBTL1
SCHEMBL4601794 0.72 ACHE (0.73) NPC1RAB9AKMT2ALMNAL3MBTL1
SCHEMBL9712873 0.72 PDE4A (0.76) NPC1RAB9AKMT2ALMNAL3MBTL1
SCHEMBL3456951 0.71 ACHE (0.65) NPC1RAB9AKMT2AL3MBTL1BCHE
SCHEMBL480432 0.71 ACHE (0.52) NPC1RAB9AKMT2ALMNAL3MBTL1

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
US-20070060667-A1 Process for preparing pigment concentrates for use in radiation-curable coatings JUNG TUNJA 2007-03-15 US disclosed
EP-1629054-A1 PROCESS FOR PREPARING PIGMENT CONCENTRATES FOR USE IN RADIATION-CURABLE COATINGS Ciba SC Holding AG (CH) 2006-03-01 EP disclosed
WO-2004106444-A1 PROCESS FOR PREPARING PIGMENT CONCENTRATES FOR USE IN RADIATION-CURABLE COATINGS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2004-12-09 WO disclosed