SCHEMBL140840

SCHEMBL140840

Cc1cc2c(cc1C)-n1c(c(Br)c3ccccc31)C2=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDO2 P48775 4/20 0.39
IDO2 Q6ZQW0 4/20 0.39
IDO1 P14902 3/20 0.39
NTRK1 P04629 6/20 0.36
KDM4E B2RXH2 1/20 0.36
NQO2 P16083 1/20 0.36
KMT2A Q03164 2/20 0.34
CHEK1 O14757 1/20 0.34
TSHR P16473 1/20 0.34
HSD17B10 Q99714 1/20 0.34
RAB9A P51151 3/20 0.33
APAF1 O14727 2/20 0.33
NPC1 O15118 2/20 0.33
MEN1 O00255 1/20 0.33
MITF O75030 1/20 0.33
HSP90AA1 P07900 1/20 0.33
CDK5 Q00535 1/20 0.33
CDK5R1 Q15078 1/20 0.33
BRD1 O95696 1/20 0.33
TAF1 P21675 1/20 0.33

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
SCHEMBL143411 0.84 TDO2 (0.39) TDO2IDO2IDO1NTRK1KMT2A
SCHEMBL143252 0.83 TDO2 (0.39) TDO2IDO2IDO1NTRK1KMT2A
SCHEMBL143408 0.82 NTRK1 (0.40) NTRK1KMT2AMEN1
SCHEMBL143247 0.80 IDO1 (0.45) TDO2IDO2IDO1NTRK1KMT2A
SCHEMBL143891 0.70 DNMT1 (0.38) TDO2IDO2IDO1KMT2ARAB9A
SCHEMBL142587 0.69 KMT2A (0.40) NTRK1KDM4EKMT2ARAB9AMEN1
SCHEMBL25822533 0.69 KDM4E (0.48) KDM4ENQO2KMT2ATSHRHSD17B10
SCHEMBL29930277 0.68 NTRK1 (0.49) TDO2IDO2IDO1NTRK1KMT2A
SCHEMBL154140 0.68 NTRK1 (0.49) TDO2IDO2IDO1NTRK1KMT2A
SCHEMBL152432 0.68 IDO1 (0.55) TDO2IDO2IDO1NTRK1KDM4E

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