SCHEMBL155669

SCHEMBL155669

COc1ccc(-c2c3n(c4ccccc24)-c2ccccc2C3=O)c(OC)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 3/20 0.53
MAPT P10636 4/20 0.48
LMNA P02545 1/20 0.48
HTT P42858 1/20 0.48
PARP1 P09874 1/20 0.47
PRKCA P17252 2/20 0.47
GSK3B P49841 2/20 0.47
PKM P14618 1/20 0.42
HSD17B10 Q99714 1/20 0.42
TP53 P04637 1/20 0.42
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
POLB P06746 1/20 0.41
KMT2A Q03164 1/20 0.41
MAPK1 P28482 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
HSP90AA1 P07900 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
CYP1A1 P04798 1/20 0.40

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
SCHEMBL3406408 0.89 NTRK1 (0.49) NTRK1MAPTLMNAHTTPARP1
SCHEMBL3404138 0.85 NTRK1 (0.46) NTRK1MAPTLMNAHTTPARP1
SCHEMBL155671 0.81 MAPT (0.45) NTRK1MAPTLMNAHTTPARP1
SCHEMBL3402828 0.81 LMNA (0.44) NTRK1MAPTLMNAHTTPARP1
SCHEMBL154801 0.75 LMNA (0.43) NTRK1MAPTLMNAHTTPARP1
SCHEMBL28866215 0.73 CYP1A1 (0.59) MAPTLMNAHTTPRKCAGSK3B
SCHEMBL142563 0.72 NTRK1 (0.48) NTRK1MAPTLMNAHTTHSD17B10
SCHEMBL8476962 0.71 NTRK1 (0.52) NTRK1MAPTLMNAHTTPRKCA
SCHEMBL155750 0.70 IDO1 (0.43) NTRK1MAPTPRKCAGSK3BTP53
SCHEMBL29930277 0.70 NTRK1 (0.49) NTRK1MAPTLMNAHTTKMT2A

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
US-8940909-B2 Indicator platform BIOSYNTH AG (CH) 2015-01-27 US disclosed
EP-2427431-B1 NOVEL INDICATOR PLATFORM BIOSYNTH AG (CH) 2013-05-01 EP disclosed
US-20120058503-A1 Novel Indicator Platform BIOSYNTH AG (CH) 2012-03-08 US disclosed
EP-2256103-A1 Novel indicator platform Biosynth AG (CH) 2010-12-01 EP disclosed