SCHEMBL22874249

SCHEMBL22874249

c1ccc(-c2cc(-c3cc(-c4ccccn4)c(-c4ncccn4)c(-c4ccccn4)c3)cc(-c3ccccn3)c2-c2ncccn2)nc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.50
CCR1 P32246 3/20 0.50
CCR5 P51681 3/20 0.50
CCR8 P51685 3/20 0.50
LMNA P02545 3/20 0.50
CYP1A2 P05177 1/20 0.50
POLB P06746 1/20 0.50
METAP1 P53582 1/20 0.50
BLM P54132 1/20 0.50
HIF1A Q16665 1/20 0.50
DOHH Q9BU89 1/20 0.50
P4HTM Q9NXG6 1/20 0.50
TP53 P04637 4/20 0.48
TDP1 Q9NUW8 2/20 0.48
NPC1 O15118 6/20 0.43
RAB9A P51151 6/20 0.43
ALOX15 P16050 3/20 0.43
L3MBTL1 Q9Y468 3/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
HTT P42858 2/20 0.43

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
SCHEMBL11965539 0.90 KDM4E (0.56) KDM4ECCR1CCR5CCR8LMNA
SCHEMBL16383311 0.86 KDM4E (0.52) KDM4ECCR1CCR5CCR8LMNA
SCHEMBL17320276 0.82 TGFBR1 (0.49) KDM4ECCR1CCR5CCR8LMNA
SCHEMBL21365408 0.79 CYP2A6 (0.50) KDM4ECCR1CCR5CCR8LMNA
SCHEMBL11965537 0.79 KDM4E (0.59) KDM4ECCR1CCR5CCR8LMNA
SCHEMBL16625770 0.78 CYP2A6 (0.34) SMN1; SMN2HTTALDH1A1HPGDMAPT
SCHEMBL21742643 0.75 KDM4E (0.44) KDM4ECCR1CCR5CCR8LMNA
SCHEMBL11965541 0.75 KDM4E (0.68) KDM4ECCR1CCR5CCR8LMNA
SCHEMBL29725567 0.75 KDM4E (0.68) KDM4ECCR1CCR5CCR8LMNA
SCHEMBL13910993 0.75 KDM4E (0.68) KDM4ECCR1CCR5CCR8LMNA

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-20210008872-A1 COMPOSITION FOR ELECTRONIC DEVICES, INK FOR ELECTRONIC DEVICES, AND METHOD FOR PRODUCING ELECTRONIC DEVICE Konica Minolta, Inc. (JP) 2021-01-14 US disclosed