SCHEMBL1466199

SCHEMBL1466199

PNc1ccccc1NP

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.33
MAPT P10636 4/20 0.33
MEN1 O00255 4/20 0.33
KMT2A Q03164 4/20 0.33
TDP1 Q9NUW8 4/20 0.33
KDM4E B2RXH2 3/20 0.33
RECQL P46063 3/20 0.33
HSD17B10 Q99714 3/20 0.33
GAA P10253 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
HTT P42858 1/20 0.33
GLA P06280 1/20 0.33
USP2 O75604 1/20 0.33
POLB P06746 1/20 0.33
HPGD P15428 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.32
MAPK10 P53779 1/20 0.32
GFER P55789 1/20 0.32
LMNA P02545 1/20 0.32

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
SCHEMBL18933042 0.78
SCHEMBL13839217 0.78
SCHEMBL14867394 0.78
SCHEMBL3849895 0.78
SCHEMBL13014982 0.73 ALDH1A1 (0.31) ALDH1A1TDP1HSD17B10GAAHTT
SCHEMBL15233485 0.71 FABP4 (0.57) ALDH1A1MEN1KMT2ATDP1KDM4E
SCHEMBL1050432 0.67
SCHEMBL4085416 0.62 MEN1 (0.35) ALDH1A1MAPTMEN1KMT2ATDP1
SCHEMBL8410093 0.61 IDO1 (0.50) ALDH1A1MAPTMEN1KMT2ATDP1
SCHEMBL16358494 0.61 ALDH1A1 (0.33) ALDH1A1MAPTMEN1KMT2ATDP1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8518368-B2 Method for the production of hydrogen from ammonia borane KANATA CHEMICAL TECHNOLOGIES INC. (CA) 2013-08-27 US disclosed
US-20110070152-A1 METHOD FOR THE PRODUCTION OF HYDROGEN FROM AMMONIA BORANE KANATA CHEMICAL TECHNOLOGIES INC. (CA) 2011-03-24 US disclosed
EP-2158154-A1 METHOD FOR THE PRODUCTION OF HYDROGEN FROM AMMONIA BORANE Kanata Chemical Technologies Inc. (CA) 2010-03-03 EP disclosed
WO-2008141439-A1 METHOD FOR THE PRODUCTION OF HYDROGEN FROM AMMONIA BORANE KANATA CHEMICAL TECHNOLOGIES INC. (CA) 2008-11-27 WO disclosed