SCHEMBL152144

SCHEMBL152144

O=C1c2ccccc2-n2c1c(O)c1ccccc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 3/20 0.49
KMT2A Q03164 3/20 0.49
NTRK1 P04629 3/20 0.49
HTT P42858 2/20 0.49
TDO2 P48775 2/20 0.49
IDO2 Q6ZQW0 2/20 0.49
LMNA P02545 2/20 0.49
NPC1 O15118 1/20 0.49
ALOX5 P09917 1/20 0.49
MAPT P10636 1/20 0.49
PTGS2 P35354 1/20 0.49
MAPK8 P45983 1/20 0.49
RAB9A P51151 1/20 0.49
NTRK2 Q16620 1/20 0.49
HDAC6 Q9UBN7 1/20 0.49
ALDH1A1 P00352 4/20 0.40
CYP2C19 P33261 3/20 0.40
HSD17B10 Q99714 2/20 0.40
KDM4E B2RXH2 3/20 0.39
GLA P06280 2/20 0.39

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
SCHEMBL3408954 0.82 IDO1 (0.55) IDO1KMT2ANTRK1HTTTDO2
SCHEMBL144098 0.80 NTRK1 (0.45) IDO1KMT2ANTRK1HTTTDO2
SCHEMBL29930277 0.80 NTRK1 (0.49) IDO1KMT2ANTRK1HTTTDO2
SCHEMBL143247 0.80 IDO1 (0.45) IDO1KMT2ANTRK1HTTTDO2
SCHEMBL154140 0.80 NTRK1 (0.49) IDO1KMT2ANTRK1HTTTDO2
SCHEMBL142571 0.80 NTRK1 (0.45) IDO1KMT2ANTRK1HTTTDO2
SCHEMBL142563 0.79 NTRK1 (0.48) IDO1KMT2ANTRK1HTTTDO2
SCHEMBL154801 0.76 LMNA (0.43) IDO1KMT2ANTRK1HTTTDO2
SCHEMBL144092 0.75 IDO1 (0.51) IDO1KMT2ANTRK1HTTTDO2
SCHEMBL3408983 0.71 KMT2A (0.38) IDO1KMT2AHTTTDO2IDO2

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 6 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
EP-2427431-A1 NOVEL INDICATOR PLATFORM Biosynth AG (CH) 2012-03-14 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
WO-2010128120-A1 NOVEL INDICATOR PLATFORM BIOSYNTH AG (CH) 2010-11-11 WO disclosed