SCHEMBL5501013

SCHEMBL5501013

CCN(CC)c1cccc2c1C(C)c1ccccc1N2

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR5A P47898 14/20 0.36
DDB1 Q16531 1/20 0.35
CRBN Q96SW2 1/20 0.35
MEN1 O00255 3/20 0.32
KMT2A Q03164 3/20 0.32
GAA P10253 2/20 0.32
GFER P55789 1/20 0.32
NPC1 O15118 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
GRK6 P43250 1/20 0.32
RAB9A P51151 1/20 0.32
HIF1A Q16665 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
HTR1A P08908 1/20 0.31
HTR1D P28221 1/20 0.31
HTR2A P28223 1/20 0.31
HTR2C P28335 1/20 0.31
HTR7 P34969 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
SCHEMBL5494475 0.83 HTR5A (0.36) HTR5AGAAALDH1A1MAPTL3MBTL1
SCHEMBL27589412 0.81 HTR5A (0.35) HTR5ADDB1CRBNMEN1KMT2A
SCHEMBL5502020 0.77 HTR5A (0.37) HTR5ADDB1CRBNHTR2AHTR2C
SCHEMBL28733042 0.74 HTR2C (0.42) HTR5ADDB1CRBNMEN1KMT2A
SCHEMBL5495275 0.73 KMT2A (0.44) MEN1KMT2AALDH1A1MAPTNPSR1
SCHEMBL13366003 0.72 HTR5A (0.48) HTR5AMEN1KMT2AGAAMAPT
SCHEMBL31474673 0.72 HTR5A (0.48) HTR5AMEN1KMT2AGAAMAPT
SCHEMBL27706751 0.67 HSD17B10 (0.41) DDB1CRBNMEN1KMT2AALDH1A1
Fluoride SCHEMBL4299936 0.66 MEN1 (0.35) DDB1CRBNMEN1KMT2AGAA
SCHEMBL3897467 0.66 ALDH1A1 (0.43) DDB1CRBNMEN1KMT2AGAA

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