SCHEMBL22360419

SCHEMBL22360419

N#CC(C#N)=NOCc1nnc(-c2cc(Cl)cc(Cl)c2)o1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 3/20 0.38
MAPT P10636 8/20 0.38
L3MBTL1 Q9Y468 3/20 0.38
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
USP2 O75604 1/20 0.37
SMN1; SMN2 Q16637 5/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 4/20 0.34
POLB P06746 3/20 0.34
PKM P14618 2/20 0.34
GAA P10253 1/20 0.34
PIP4K2A P48426 1/20 0.34
HTT P42858 1/20 0.33
HPGD P15428 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
LMNA P02545 1/20 0.33
RECQL P46063 1/20 0.33

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
SCHEMBL22360371 0.88 NPC1 (0.48) NOTUMMAPTL3MBTL1KMT2ASMN1; SMN2
SCHEMBL22360375 0.87 MAPT (0.51) MAPTL3MBTL1MEN1KMT2AUSP2
SCHEMBL22360418 0.83 L3MBTL1 (0.36) NOTUMMAPTL3MBTL1KMT2AUSP2
SCHEMBL22360420 0.81 SMN1; SMN2 (0.55) NOTUMMAPTL3MBTL1MEN1KMT2A
SCHEMBL22360494 0.81 L3MBTL1 (0.39) NOTUMMAPTL3MBTL1MEN1KMT2A
SCHEMBL22360416 0.81 NOTUM (0.37) NOTUMMAPTL3MBTL1SMN1; SMN2NPC1
SCHEMBL22360490 0.81 NPC1 (0.42) NOTUMMAPTL3MBTL1MEN1KMT2A
SCHEMBL22360489 0.80 SMN1; SMN2 (0.45) NOTUMMAPTL3MBTL1MEN1KMT2A
SCHEMBL22360379 0.79 POLB (0.49) MAPTL3MBTL1KMT2ASMN1; SMN2NPC1
SCHEMBL22360381 0.79 NPC1 (0.40) NOTUMMAPTL3MBTL1MEN1KMT2A

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-2020164403-A1 1,1-DICYANO-OXIME-ETHER COMPOUND AND APPLICATION THEREOF 沈阳化工大学 2020-08-20 WO disclosed