SCHEMBL26478149

SCHEMBL26478149

Cc1ccc(-c2n[nH]c(-c3cccc(N)c3)n2)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATAD2 Q6PL18 1/20 0.68
NR1H2 P55055 5/20 0.68
NR1H3 Q13133 5/20 0.68
NPC1 O15118 5/20 0.59
RAB9A P51151 5/20 0.59
LMNA P02545 1/20 0.59
SMN1; SMN2 Q16637 4/20 0.51
ALDH1A1 P00352 3/20 0.51
MAPT P10636 3/20 0.51
HPGD P15428 3/20 0.51
KDM4E B2RXH2 2/20 0.51
GFER P55789 2/20 0.51
TP53 P04637 1/20 0.51
PKM P14618 1/20 0.51
DGAT1 O75907 1/20 0.48
PDPK1 O15530 1/20 0.47
ATR Q13535 1/20 0.46
ADORA2A P29274 1/20 0.46
ADORA1 P30542 1/20 0.46
MEN1 O00255 2/20 0.46

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
SCHEMBL26465286 0.85 ATAD2 (0.63) ATAD2NR1H2NR1H3NPC1RAB9A
SCHEMBL17280030 0.83 NR1H2 (0.78) ATAD2NR1H2NR1H3NPC1RAB9A
SCHEMBL16771445 0.81 ATAD2 (1.00) ATAD2NR1H2NR1H3NPC1RAB9A
SCHEMBL17279689 0.81 NR1H2 (1.00) ATAD2NR1H2NR1H3NPC1RAB9A
SCHEMBL28146139 0.81 NR1H2 (1.00) ATAD2NR1H2NR1H3NPC1RAB9A
SCHEMBL12228171 0.81 NR1H2 (0.86) ATAD2NR1H2NR1H3NPC1RAB9A
SCHEMBL12171912 0.79 NR1H2 (0.67) ATAD2NR1H2NR1H3NPC1RAB9A
SCHEMBL17280032 0.76 ATAD2 (0.59) ATAD2NR1H2NR1H3NPC1RAB9A
SCHEMBL16712165 0.76 NR1H2 (0.68) NR1H2NR1H3NPC1RAB9ALMNA
SCHEMBL17279769 0.76 NR1H2 (0.75) ATAD2NR1H2NR1H3NPC1RAB9A

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
WO-2023073115-A1 PROTEIN AGGREGATION INHIBITING COMPOUNDS FOR PLANT DISEASE CONTROL MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2023-05-04 WO disclosed