SCHEMBL17596123

SCHEMBL17596123

CSc1ccc(-c2c(C)c(C(=O)NC3(C)N=NN=N3)cc3cccnc23)cc1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.40
KMT2A Q03164 4/20 0.40
MEN1 O00255 2/20 0.40
RAB9A P51151 4/20 0.34
PDE4A P27815 4/20 0.33
PDE4B Q07343 2/20 0.33
PDE4D Q08499 2/20 0.33
PDE4C Q08493 1/20 0.33
CASP3 P42574 1/20 0.32
SENP8 Q96LD8 1/20 0.32
SENP7 Q9BQF6 1/20 0.32
SENP6 Q9GZR1 1/20 0.32
KCNH2 Q12809 1/20 0.32
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
KDR P35968 1/20 0.32
CHRNA7 P36544 1/20 0.32
LMNA P02545 1/20 0.32

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
SCHEMBL17596178 0.85 ATR (0.39) PDE4APDE4BPDE4DPDE4CLMNA
SCHEMBL17596182 0.82 KMT2A (0.37) NPC1KMT2AMEN1PDE4APDE4B
SCHEMBL17596559 0.81 PDE4A (0.43) NPC1KMT2AMEN1PDE4APDE4B
SCHEMBL17596177 0.80 NPC1 (0.42) NPC1KMT2AMEN1RAB9A
SCHEMBL17596505 0.78 MEN1 (0.38) KMT2AMEN1PDE4APDE4BPDE4D
SCHEMBL17595555 0.76 KMT2A (0.39) NPC1KMT2AMEN1RAB9APDE4A
SCHEMBL17596608 0.76 L3MBTL1 (0.40) PDE4APDE4BPDE4DPDE4C
SCHEMBL17596122 0.76 POLB (0.43) NPC1KMT2AMEN1RAB9APDE4A
SCHEMBL17596566 0.75 PDE4A (0.37) KMT2AMEN1PDE4APDE4BPDE4D
SCHEMBL17596188 0.69 PDE4A (0.41) NPC1KMT2AMEN1RAB9APDE4A

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-3191465-A1 HERBICIDAL QUINOLINES Syngenta Participations AG (CH) 2017-07-19 EP disclosed
WO-2016038173-A1 HERBICIDAL QUINOLINES SYNGENTA PARTICIPATIONS AG (CH) 2016-03-17 WO disclosed