SCHEMBL3469137

SCHEMBL3469137

CCCCn1cc(-c2nc(-c3ccc(O)c(C)c3O)nc(-c3ccc(O)c(C)c3O)n2)c2cc(OC)ccc21

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ABCC2 Q92887 1/20 0.45
TLR8 Q9NR97 1/20 0.41
CNR2 P34972 3/20 0.41
KDM4E B2RXH2 1/20 0.41
HSD17B10 Q99714 1/20 0.41
PDE4B Q07343 2/20 0.39
PDE4D Q08499 2/20 0.39
HTR6 P50406 1/20 0.39
GSK3B P49841 5/20 0.38
QPCT Q16769 5/20 0.38
ICMT O60725 1/20 0.36

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
SCHEMBL3362115 0.86 PDE4B (0.36) ABCC2TLR8CNR2KDM4EHSD17B10
SCHEMBL3469903 0.85 PDE4B (0.39) KDM4EHSD17B10PDE4BPDE4DHTR6
SCHEMBL3468921 0.83 ABCC2 (0.37) ABCC2TLR8CNR2KDM4EHSD17B10
SCHEMBL3360889 0.80 MGLL (0.33) TLR8CNR2KDM4EHSD17B10PDE4B
SCHEMBL3477772 0.79 NPC1 (0.39) KDM4EHSD17B10PDE4BPDE4D
SCHEMBL3474171 0.76 PDE4B (0.34) ABCC2TLR8CNR2KDM4EHSD17B10
SCHEMBL3469068 0.75 CRHR1 (0.34) ABCC2TLR8CNR2KDM4EHSD17B10
SCHEMBL3359268 0.75 CRHR1 (0.34) ABCC2TLR8CNR2KDM4EHSD17B10
SCHEMBL3468899 0.75 CRHR1 (0.34) ABCC2TLR8CNR2KDM4EHSD17B10
SCHEMBL3475364 0.74 ADAM17 (0.34) ABCC2TLR8CNR2PDE4BPDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010081835-A2 BIS-RESORCINYL-TRIAZINE DERIVATIVES AS PROTECTING AGENTS AGAINST UV RADIATION ISDIN, S. A. (ES) 2010-07-22 WO disclosed