SCHEMBL5494475

SCHEMBL5494475

CC1c2ccccc2Nc2cccc(N(C)C)c21

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR5A P47898 11/20 0.36
MAPT P10636 4/20 0.35
KDM4E B2RXH2 2/20 0.35
GAA P10253 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
HTR1A P08908 2/20 0.33
HTR1D P28221 2/20 0.33
HTR2C P28335 2/20 0.33
HTR7 P34969 2/20 0.33
HTR2A P28223 1/20 0.33
HTR3A P46098 1/20 0.33
HTR6 P50406 1/20 0.33
HRH1 P35367 1/20 0.33
TSHR P16473 1/20 0.33
BRD4 O60885 1/20 0.33
CREBBP Q92793 1/20 0.33
GSK3B P49841 1/20 0.31
ALDH1A1 P00352 2/20 0.31
NSD2 O96028 1/20 0.31
EGFR P00533 1/20 0.31

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
SCHEMBL5501013 0.83 HTR5A (0.36) HTR5AMAPTGAAL3MBTL1HTR1A
SCHEMBL28733042 0.77 HTR2C (0.42) HTR5AHTR1AHTR1DHTR2CHTR7
SCHEMBL11573586 0.77 MAPT (0.39) MAPTKDM4EGAAL3MBTL1HTR6
SCHEMBL13366003 0.75 HTR5A (0.48) HTR5AMAPTGAAHTR2CTSHR
SCHEMBL31474673 0.75 HTR5A (0.48) HTR5AMAPTGAAHTR2CTSHR
SCHEMBL5496349 0.73 HTR5A (0.38) HTR5AMAPTKDM4EGAAL3MBTL1
SCHEMBL3905870 0.70 GRM2 (0.41) MAPTKDM4EGAAL3MBTL1HTR2C
SCHEMBL20777509 0.69 KDM4E (0.41) HTR5AMAPTKDM4EGAAHTR1A
SCHEMBL5500090 0.67 MAPT (0.40) HTR5AMAPTKDM4EGAAL3MBTL1
SCHEMBL20385185 0.67 HTR5A (0.48) HTR5AMAPTGAAHTR2CTSHR

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-1765592-A1 METHOD FOR MAKING NEGATIVE-WORKING HEAT-SENSITIVE LITHOGRAPHIC PRINTING PLATE PRECURSOR Agfa Graphics N.V. (BE) 2007-03-28 EP disclosed
WO-2006005688-A1 METHOD FOR MAKING NEGATIVE-WORKING HEAT-SENSITIVE LITHOGRAPHIC PRINTING PLATE PRECURSOR. AGFA-GEVAERT (BE) 2006-01-19 WO disclosed