SCHEMBL12377700

SCHEMBL12377700

CC[n+]1c2ccccc2nc2c(OCCCCN)cccc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1B P28222 2/20 0.41
MCHR1 Q99705 4/20 0.41
L3MBTL1 Q9Y468 2/20 0.40
MEN1 O00255 2/20 0.40
POLB P06746 2/20 0.40
KMT2A Q03164 2/20 0.40
NPC1 O15118 1/20 0.40
USP2 O75604 1/20 0.40
RAB9A P51151 1/20 0.40
BLM P54132 1/20 0.40
NLRP3 Q96P20 1/20 0.40
TLR8 Q9NR97 5/20 0.39
NCF1 P14598 3/20 0.38
CSNK1A1 P48729 1/20 0.36
CSNK1D P48730 1/20 0.36
PRKCD Q05655 1/20 0.36
PAK1 Q13153 1/20 0.36
CAMK2B Q13554 1/20 0.36
CAMK2G Q13555 1/20 0.36
CAMK2D Q13557 1/20 0.36

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
SCHEMBL12377709 0.88 NPC1 (0.40) MCHR1L3MBTL1MEN1POLBKMT2A
SCHEMBL12377705 0.86 MEN1 (0.40) MCHR1L3MBTL1MEN1POLBKMT2A
SCHEMBL12377694 0.81 LTB4R (0.42) L3MBTL1MEN1POLBKMT2ANPC1
SCHEMBL12377706 0.80 NPC1 (0.36) MCHR1L3MBTL1MEN1POLBKMT2A
Acetic Acid SCHEMBL1258679 0.80 LTB4R (0.41) L3MBTL1MEN1POLBKMT2ANPC1
SCHEMBL12377702 0.79 RAB9A (0.44) L3MBTL1MEN1KMT2ANPC1RAB9A
SCHEMBL23855076 0.79 NQO2 (0.56) MCHR1L3MBTL1MEN1POLBKMT2A
SCHEMBL35210324 0.79 NQO2 (0.56) MCHR1L3MBTL1MEN1POLBKMT2A
Acetic Acid SCHEMBL1258682 0.78 LTB4R (0.40) MEN1KMT2A
SCHEMBL1258702 0.77 LTB4R (0.39) L3MBTL1MEN1POLBKMT2ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2265726-B1 BIOSENSOR WITH IMPROVED ANALYTE SPECIFICITY ROCHE DIAGNOSTICS GMBH (DE) 2014-05-07 EP disclosed
US-8535511-B2 Methods for electrochemical analysis using matrix compositions with alkylphenazine quaternary salt and a nitrosoaniline ROCHE DIAGNOSTICS OPERATIONS, INC. (US) 2013-09-17 US disclosed
US-8008037-B2 Matrix composition with alkylphenazine quaternary salt and a nitrosoaniline ROCHE DIAGNOSTICS OPERATIONS, INC. (US) 2011-08-30 US disclosed
US-8008037-B2 Matrix composition with alkylphenazine quaternary salt and a nitrosoaniline ROCHE DIAGNOSTICS OPERATIONS, INC. (US) 2011-08-30 US disclosed
WO-2009118157-A1 BIOSENSOR WITH IMPROVED ANALYTE SPECIFICITY ROCHE DIAGNOSTICS GMBH (DE) 2009-10-01 WO disclosed
US-20090246808-A1 BIOSENSOR WITH IMPROVED ANALYTE SPECIFICITY ROCHE DIABETES CARE, INC. 2009-10-01 US disclosed
US-20090246808-A1 BIOSENSOR WITH IMPROVED ANALYTE SPECIFICITY ROCHE DIABETES CARE, INC. 2009-10-01 US disclosed