SCHEMBL14514280

SCHEMBL14514280

COc1ccc(-c2nc(-c3ccc(OCCO)cc3O)nc(-c3ccc(OCCO)cc3O)n2)c(O)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.59
MAPT P10636 7/20 0.49
KMT2A Q03164 5/20 0.49
MEN1 O00255 4/20 0.49
MAPK1 P28482 3/20 0.49
HTT P42858 3/20 0.49
NCOA1 Q15788 2/20 0.49
NCOA3 Q9Y6Q9 2/20 0.49
TP53 P04637 2/20 0.49
TSHR P16473 2/20 0.49
MAPK10 P53779 2/20 0.49
PTK2B Q14289 1/20 0.49
GFER P55789 1/20 0.49
IDH1 O75874 1/20 0.48
LMNA P02545 3/20 0.47
NPSR1 Q6W5P4 5/20 0.45
KDM4E B2RXH2 2/20 0.45
NOD2 Q9HC29 1/20 0.45
ALOX15 P16050 1/20 0.45
ALOX12 P18054 1/20 0.45

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
SCHEMBL4977473 0.93 NPC1 (0.51) NPC1MAPTKMT2AMEN1MAPK1
SCHEMBL4978800 0.92 NPC1 (0.46) NPC1MAPTKMT2AMEN1MAPK1
SCHEMBL14514279 0.88 MAPT (0.49) NPC1MAPTKMT2AMEN1MAPK1
SCHEMBL4979511 0.87 NPC1 (0.46) NPC1MAPTKMT2AMEN1MAPK1
SCHEMBL12802917 0.87 MAPK1 (0.44) NPC1MAPTKMT2AMEN1MAPK1
SCHEMBL4980859 0.86 LMNA (0.49) NPC1MAPTKMT2AMEN1MAPK1
SCHEMBL4977185 0.86 L3MBTL1 (0.43) NPC1MAPTKMT2AMEN1MAPK1
SCHEMBL13030444 0.85 NPC1 (0.77) NPC1MAPTKMT2AMEN1MAPK1
SCHEMBL14036590 0.85 NPC1 (0.41) NPC1MAPTKMT2AMEN1MAPK1
SCHEMBL4982121 0.85 NPC1 (0.41) NPC1MAPTKMT2AMEN1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7214742-B2 2-hydroxyphenyl-s-triazine crosslinkers for polymer networks CIBA SPECIALTY CHEMICALS CORP. (US) 2007-05-08 US disclosed
US-7214742-B2 2-hydroxyphenyl-s-triazine crosslinkers for polymer networks CIBA SPECIALTY CHEMICALS CORP. (US) 2007-05-08 US disclosed