SCHEMBL154458

SCHEMBL154458

O=C1c2ccc(Cl)cc2-n2c1c(-c1ccccc1)c1ccccc12

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.54
TDO2 P48775 1/20 0.54
IDO2 Q6ZQW0 1/20 0.54
MDM2 Q00987 2/20 0.43
APAF1 O14727 1/20 0.42
NTRK1 P04629 2/20 0.40
MDM4 O15151 1/20 0.40
PDE4A P27815 1/20 0.39
DPP4 P27487 1/20 0.39
KMT2A Q03164 2/20 0.39
S100A4 P26447 1/20 0.37
KDM4E B2RXH2 2/20 0.37
MAPK1 P28482 1/20 0.37
ACLY P53396 1/20 0.37
MEN1 O00255 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
MAPK14 Q16539 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
SCHEMBL3404195 0.93 IDO1 (0.50) IDO1TDO2IDO2MDM2APAF1
SCHEMBL155750 0.85 IDO1 (0.43) IDO1TDO2IDO2NTRK1KDM4E
SCHEMBL142563 0.83 NTRK1 (0.48) IDO1TDO2IDO2NTRK1KMT2A
SCHEMBL3408954 0.82 IDO1 (0.55) IDO1TDO2IDO2APAF1NTRK1
SCHEMBL152432 0.82 IDO1 (0.55) IDO1TDO2IDO2APAF1NTRK1
SCHEMBL152297 0.81 IDO1 (0.46) IDO1TDO2IDO2APAF1NTRK1
SCHEMBL3408432 0.80 IDO1 (0.46) IDO1TDO2IDO2APAF1NTRK1
SCHEMBL153093 0.80 IDO1 (0.46) IDO1TDO2IDO2MDM2MDM4
SCHEMBL24948911 0.78 IDO1 (0.46) IDO1TDO2IDO2MDM2APAF1
SCHEMBL3406408 0.78 NTRK1 (0.49) IDO1TDO2IDO2NTRK1KMT2A

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