SCHEMBL13610027

SCHEMBL13610027

Cc1cc(-c2cccc(-c3ccccn3)n2)n(C)n1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.55
LMNA P02545 4/20 0.55
TP53 P04637 4/20 0.55
SMN1; SMN2 Q16637 4/20 0.55
CCR1 P32246 3/20 0.55
CCR5 P51681 3/20 0.55
CCR8 P51685 3/20 0.55
HTT P42858 3/20 0.55
TDP1 Q9NUW8 3/20 0.55
MAPK1 P28482 2/20 0.55
ALOX15 P16050 2/20 0.55
L3MBTL1 Q9Y468 2/20 0.55
ALPL P05186 2/20 0.55
HSP90AA1 P07900 1/20 0.55
ALPI P09923 1/20 0.55
ALPG P10696 1/20 0.55
POLB P06746 3/20 0.42
BLM P54132 2/20 0.42
CYP1A2 P05177 1/20 0.42
METAP1 P53582 1/20 0.42

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
SCHEMBL10513619 0.89 NPC1 (0.46) KDM4ELMNATP53SMN1; SMN2CCR1
SCHEMBL13184344 0.77 KDM4E (0.52) KDM4ELMNATP53SMN1; SMN2CCR1
SCHEMBL14255745 0.75 KDM4E (0.75) KDM4ELMNATP53SMN1; SMN2CCR1
Terpyridine SCHEMBL30610403 0.74 KDM4E (0.90) KDM4ELMNATP53SMN1; SMN2CCR1
SCHEMBL7964803 0.74 KDM4E (1.00) KDM4ELMNATP53SMN1; SMN2CCR1
Terpyridine SCHEMBL29357603 0.74 KDM4E (1.00) KDM4ELMNATP53SMN1; SMN2CCR1
SCHEMBL30172832 0.74 KDM4E (1.00) KDM4ELMNATP53SMN1; SMN2CCR1
Terpyridine SCHEMBL57442 0.74 KDM4E (1.00) KDM4ELMNATP53SMN1; SMN2CCR1
SCHEMBL21241337 0.74 CCR1 (0.57) KDM4ECCR1CCR5CCR8HTT
SCHEMBL863171 0.74 KDM4E (0.67) KDM4ELMNATP53SMN1; SMN2CCR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7615636-B2 Ruthenium complexes with tridentate heterocyclic ligand and dye-sensitized solar cells using the same INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2009-11-10 US disclosed