SCHEMBL3319342

SCHEMBL3319342

C=CCOC(=O)C(=C)C(=C)N

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.44
CACNA1B Q00975 1/20 0.44
APBA1 Q02410 1/20 0.44
CYP3A4 P08684 1/20 0.38
ALDH1A1 P00352 6/20 0.37
TSHR P16473 3/20 0.37
HSD17B10 Q99714 2/20 0.37
TDP1 Q9NUW8 1/20 0.33
MEN1 O00255 3/20 0.31
KMT2A Q03164 3/20 0.31
MAPK1 P28482 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
FGFR4 P22455 1/20 0.31
PTP4A3 O75365 1/20 0.31
PTP4A1 Q93096 1/20 0.31
KDM4E B2RXH2 2/20 0.30
TP53 P04637 1/20 0.30
HPGD P15428 1/20 0.30
PKM P14618 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
SCHEMBL432465 0.86
SCHEMBL8409550 0.86 CYP3A4 (0.43) MAPTCACNA1BAPBA1CYP3A4ALDH1A1
SCHEMBL2733016 0.80 CYP3A4 (0.39) MAPTCACNA1BAPBA1CYP3A4ALDH1A1
SCHEMBL5716647 0.79
SCHEMBL5140277 0.78 TSHR (0.40) MAPTCACNA1BAPBA1CYP3A4ALDH1A1
SCHEMBL11070215 0.78 CYP3A4 (0.38) MAPTCACNA1BAPBA1CYP3A4ALDH1A1
SCHEMBL177943 0.78 CYP3A4 (0.48) MAPTCACNA1BAPBA1CYP3A4ALDH1A1
SCHEMBL17960733 0.77 ALDH1A1 (0.44) MAPTCACNA1BAPBA1CYP3A4ALDH1A1
SCHEMBL288622 0.77 ALDH1A1 (0.39) MAPTCACNA1BAPBA1CYP3A4ALDH1A1
SCHEMBL18009544 0.77 CYP3A4 (0.37) MAPTCACNA1BAPBA1CYP3A4ALDH1A1

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-7731867-B2 Transition metal catalyst, an electroconductive material such as graphite; and a polymer binder blend of high molecular weight and low molecular weight acrylic (co)polymers, one having a higher glass transition temperature (Tg); catalytic inks for screen printing; use to make electrochemical sensors ANIMAS TECHNOLOGIES, LLC (US) 2010-06-08 US disclosed
US-20070170402-A1 Transition metal catalyst, an electroconductive material such as graphite; and a polymer binder blend of high molecular weight and low molecular weight acrylic (co)polymers, one having a higher glass transition temperature (Tg); catalytic inks for screen printing; use to make electrochemical sensors LIFESCAN IP HOLDINGS, LLC 2007-07-26 US disclosed
US-7189341-B2 Transition metal catalyst, an electroconductive material such as graphite; and a polymer binder blend of high molecular weight and low molecular weight acrylic (co)polymers, one having a higher glass transition temperature (Tg); catalytic inks for screen printing; use to make electrochemical sensors ANIMAS TECHNOLOGIES, LLC (US) 2007-03-13 US disclosed
US-20050036020-A1 Electrochemical sensor ink compositions, electrodes, and uses thereof LIFESCAN IP HOLDINGS, LLC 2005-02-17 US disclosed