SCHEMBL155403

SCHEMBL155403

Cc1c2n(c3ccccc13)-c1ccc(Br)c(Cl)c1C2=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.34
TDO2 P48775 2/20 0.34
IDO2 Q6ZQW0 2/20 0.34
JAK2 O60674 1/20 0.34
BTK Q06187 1/20 0.34
NTRK1 P04629 3/20 0.33
APAF1 O14727 1/20 0.32
HDAC3 O15379 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC2 Q92769 1/20 0.31
HDAC10 Q969S8 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
NCOR2 Q9Y618 1/20 0.31
ALDH1A1 P00352 2/20 0.31
NPSR1 Q6W5P4 1/20 0.31
ACLY P53396 1/20 0.31
KDM4E B2RXH2 2/20 0.30
MAPT P10636 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL155109 0.84 KMT2A (0.38) IDO1TDO2IDO2JAK2BTK
SCHEMBL3408983 0.84 KMT2A (0.38) IDO1TDO2IDO2JAK2BTK
SCHEMBL289010 0.80 IDO1 (0.54) IDO1TDO2IDO2NTRK1ACLY
SCHEMBL3402828 0.76 LMNA (0.44) NTRK1ALDH1A1NPSR1KDM4EMAPT
SCHEMBL29930277 0.71 NTRK1 (0.49) IDO1TDO2IDO2NTRK1HDAC6
SCHEMBL154140 0.71 NTRK1 (0.49) IDO1TDO2IDO2NTRK1HDAC6
SCHEMBL152432 0.70 IDO1 (0.55) IDO1TDO2IDO2NTRK1APAF1
SCHEMBL22599760 0.68 JAK2 (0.37) JAK2BTKHDAC3HDAC1HDAC2
SCHEMBL143891 0.67 DNMT1 (0.38) IDO1TDO2IDO2ALDH1A1MAPT
SCHEMBL15768994 0.66 KDM4E (0.41) JAK2BTKALDH1A1KDM4EMAPT

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