SCHEMBL144099

SCHEMBL144099

O=C1c2ccccc2-n2c1cc1cc(F)ccc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDO2 P48775 4/20 0.49
IDO2 Q6ZQW0 4/20 0.49
IDO1 P14902 5/20 0.40
KMT2A Q03164 4/20 0.40
NPC1 O15118 3/20 0.40
RAB9A P51151 3/20 0.40
MEN1 O00255 3/20 0.40
APAF1 O14727 1/20 0.40
MITF O75030 1/20 0.40
HSP90AA1 P07900 1/20 0.40
MAPT P10636 4/20 0.39
MAPK1 P28482 1/20 0.39
ALDH1A1 P00352 3/20 0.38
KDM4E B2RXH2 2/20 0.38
HPGD P15428 2/20 0.38
USP2 O75604 1/20 0.38
TNNI3 P19429 1/20 0.38
CASP1 P29466 1/20 0.38
BRCA1 P38398 1/20 0.38
TNNT2 P45379 1/20 0.38

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
SCHEMBL29930335 0.88 TDO2 (0.49) TDO2IDO2IDO1KMT2ANPC1
SCHEMBL28894154 0.88 TDO2 (0.49) TDO2IDO2IDO1KMT2ANPC1
SCHEMBL29929810 0.82 MAPT (0.43) TDO2IDO2IDO1KMT2ANPC1
SCHEMBL143400 0.82 MAPT (0.43) TDO2IDO2IDO1KMT2ANPC1
SCHEMBL29930158 0.82 PTPRC (0.41) TDO2IDO2IDO1KMT2ANPC1
SCHEMBL140833 0.82 MAPT (0.45) TDO2IDO2IDO1KMT2ANPC1
SCHEMBL142579 0.82 PTPRC (0.41) TDO2IDO2IDO1KMT2ANPC1
SCHEMBL29930121 0.82 MAPT (0.45) TDO2IDO2IDO1KMT2ANPC1
SCHEMBL199137 0.82 MAPT (0.39) TDO2IDO2IDO1KMT2ANPC1
SCHEMBL143890 0.82 S100A4 (0.41) TDO2IDO2IDO1KMT2ANPC1

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
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
US-20120058503-A1 Novel Indicator Platform BIOSYNTH AG (CH) 2012-03-08 US disclosed
WO-2010128120-A1 NOVEL INDICATOR PLATFORM BIOSYNTH AG (CH) 2010-11-11 WO disclosed