SCHEMBL4621722

SCHEMBL4621722

O=C(c1ccccc1)C1C=CC=CC1(Cl)Cl

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
HTT P42858 2/20 0.37
MAPT P10636 1/20 0.37
ALOX15 P16050 1/20 0.37
HBB P68871 1/20 0.37
EPHX1 P07099 2/20 0.36
CES1 P23141 4/20 0.34
CES2 O00748 3/20 0.34
ALDH1A1 P00352 2/20 0.34
DAO P14920 1/20 0.34
TSHR P16473 1/20 0.34
NAPRT Q6XQN6 1/20 0.34
TRPA1 O75762 1/20 0.33
MAPK1 P28482 1/20 0.33
GSK3B P49841 1/20 0.33
HIF1A Q16665 1/20 0.33
MCL1 Q07820 1/20 0.33
EP300 Q09472 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL29067489 0.83 NPC1 (0.41) NPC1L3MBTL1HTTMAPTALOX15
SCHEMBL1828048 0.81 L3MBTL1 (0.41) NPC1L3MBTL1HTTMAPTALOX15
SCHEMBL7851780 0.81 L3MBTL1 (0.41) NPC1L3MBTL1HTTMAPTALOX15
SCHEMBL28014454 0.78 NPC1 (0.42) NPC1L3MBTL1HTTMAPTALOX15
SCHEMBL6938598 0.78 L3MBTL1 (0.39) NPC1L3MBTL1HTTMAPTALOX15
SCHEMBL28359455 0.77 NPC1 (0.37) NPC1L3MBTL1MAPTALOX15CES1
SCHEMBL5564543 0.77 L3MBTL1 (0.38) NPC1L3MBTL1HTTMAPTALOX15
SCHEMBL8547645 0.77 L3MBTL1 (0.38) NPC1L3MBTL1HTTMAPTALOX15
SCHEMBL10959754 0.76 NPC1 (0.40) NPC1L3MBTL1HTTMAPTALOX15
SCHEMBL9407424 0.75 ALDH1A1 (0.33) NPC1L3MBTL1HTTMAPTALDH1A1

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-1754042-B8 RADIATION-CURING METHOD FOR COATINGS BASF SE (DE) 2008-04-02 EP disclosed
EP-1754042-A1 RADIATION-CURING METHOD FOR COATINGS BASF AKTIENGESELLSCHAFT (DE) 2007-02-21 EP disclosed
WO-2005119208-A1 RADIATION-CURING METHOD FOR COATINGS BASF AKTIENGESELLSCHAFT (DE) 2005-12-15 WO disclosed
WO-2004092227-A1 METHOD FOR THE PRODUCTION OF POLYISOBUTENYL (METH)ACRYLATES BASF AKTIENGESELLSCHAFT (DE) 2004-10-28 WO disclosed