SCHEMBL6858113

SCHEMBL6858113

Nc1cc2nc3ccc(N)c(N)c3nc2cc1N

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.52
KMT2A Q03164 8/20 0.52
MEN1 O00255 6/20 0.52
POLB P06746 5/20 0.52
NPC1 O15118 4/20 0.52
L3MBTL1 Q9Y468 2/20 0.52
USP2 O75604 2/20 0.52
CACNA1B Q00975 1/20 0.52
APBA1 Q02410 1/20 0.52
RAB9A P51151 6/20 0.42
KDM4E B2RXH2 5/20 0.42
BLM P54132 4/20 0.42
THRB P10828 3/20 0.42
GAA P10253 3/20 0.42
MAPK1 P28482 1/20 0.42
ATM Q13315 1/20 0.42
APAF1 O14727 1/20 0.37
LMNA P02545 5/20 0.35
HTT P42858 3/20 0.35
HIF1A Q16665 2/20 0.35

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
Hydrochloric Acid SCHEMBL25288906 0.98 MAPT (0.50) MAPTKMT2AMEN1POLBNPC1
SCHEMBL29670010 0.83 MAPT (0.59) MAPTKMT2AMEN1POLBNPC1
SCHEMBL1856937 0.83 MAPT (0.59) MAPTKMT2AMEN1POLBNPC1
Hydrochloric Acid SCHEMBL27287849 0.81 MAPT (0.58) MAPTKMT2AMEN1POLBNPC1
SCHEMBL26185533 0.77 MAPT (0.44) MAPTKMT2AMEN1POLBNPC1
SCHEMBL837057 0.75 KMT2A (0.72) MAPTKMT2AMEN1POLBNPC1
SCHEMBL29428970 0.75 KMT2A (0.72) MAPTKMT2AMEN1POLBNPC1
SCHEMBL9534423 0.74 MAPT (0.39) MAPTKMT2AMEN1NPC1L3MBTL1
SCHEMBL12964209 0.74 MAPT (0.70) MAPTKMT2AMEN1NPC1L3MBTL1
Hydrochloric Acid SCHEMBL31429084 0.72 KMT2A (0.68) MAPTKMT2AMEN1POLBNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1430560-A2 POLYMER MEMBRANE FOR FUEL CELLS AND METHOD FOR THE PRODUCTION THEREOF Institut für Polymerforschung Dresden e.V. (DE) 2004-06-23 EP disclosed
WO-2003030289-A2 POLYMER MEMBRANE FOR FUEL CELLS AND METHOD FOR THE PRODUCTION THEREOF INSTITUT FÜR POLYMERFORSCHUNG DRESDEN E.V. (DE) 2003-04-10 WO disclosed