SCHEMBL12374444

SCHEMBL12374444

CCN(C)c1ccc(C(c2ccc(N(CC)CC)cc2)c2ccc(N(CC)CC)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRK6 P43250 1/20 0.49
ALDH1A1 P00352 4/20 0.47
TSHR P16473 2/20 0.47
PSMD14 O00487 1/20 0.47
CYP3A4 P08684 1/20 0.47
MAPK1 P28482 1/20 0.47
RECQL P46063 1/20 0.47
GFER P55789 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
ALDH3A1 P30838 1/20 0.44
ALDH1A3 P47895 1/20 0.44
CNR2 P34972 9/20 0.44
ADRA2A P08913 1/20 0.42
ADRA2B P18089 1/20 0.42
ADRA2C P18825 1/20 0.42
SLC2A1 P11166 1/20 0.40
KDM4E B2RXH2 1/20 0.39
GAA P10253 1/20 0.39
TERT O14746 1/20 0.37

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
SCHEMBL14948156 0.93 CNR2 (0.47) GRK6ALDH1A1TSHRPSMD14CYP3A4
SCHEMBL13921541 0.91 GRK6 (0.43) GRK6ALDH1A1TSHRPSMD14CYP3A4
SCHEMBL131813 0.89 ALDH1A1 (0.56) GRK6ALDH1A1TSHRPSMD14CYP3A4
SCHEMBL9699686 0.86 SLC2A1 (0.55) GRK6ALDH1A1TSHRPSMD14CYP3A4
SCHEMBL5007896 0.86 SLC2A1 (0.55) GRK6ALDH1A1TSHRPSMD14CYP3A4
SCHEMBL5011804 0.86 SLC2A1 (0.55) GRK6ALDH1A1TSHRPSMD14CYP3A4
SCHEMBL13069328 0.86 SLC2A1 (0.55) ALDH1A1TSHRCYP3A4MAPK1TDP1
SCHEMBL109699 0.82 CNR2 (0.53) GRK6ALDH1A1TSHRPSMD14CYP3A4
SCHEMBL9658375 0.82 GRK6 (0.54) GRK6ALDH1A1TSHRPSMD14CYP3A4
SCHEMBL18708852 0.82 GRK6 (0.54) GRK6ALDH1A1TSHRPSMD14CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8303671-B2 Mixture of basic dye and acid dye with wax XEROX CORPORATION (US) 2012-11-06 US disclosed
US-7997712-B2 Phase change inks containing colorant compounds XEROX CORPORATION (US) 2011-08-16 US disclosed
US-7997712-B2 Phase change inks containing colorant compounds XEROX CORPORATION (US) 2011-08-16 US disclosed
US-7582687-B2 Phase change inks XEROX CORPORATION (US) 2009-09-01 US disclosed
US-7572845-B2 Phase change inks XEROX CORPORATION (US) 2009-08-11 US disclosed
US-7504446-B2 Aqueous inks containing colored polymers XEROX CORPORATION (US) 2009-03-17 US disclosed
EP-1958992-A1 Phase change inks containing colorant compounds Xerox Corporation (US) 2008-08-20 EP disclosed
US-20080186371-A1 Phase change inks containing colorant compounds XEROX CORPORATION 2008-08-07 US disclosed
US-20080186371-A1 Phase change inks containing colorant compounds XEROX CORPORATION 2008-08-07 US disclosed
US-20080184911-A1 Colorant compounds XEROX CORPORATION 2008-08-07 US disclosed
US-7304173-B2 Colorant compositions XEROX CORPORATION (US) 2007-12-04 US disclosed