SCHEMBL22360375

SCHEMBL22360375

N#CC(C#N)=NOCc1nnc(-c2ccc(Cl)cc2)o1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.51
KMT2A Q03164 3/20 0.50
MEN1 O00255 2/20 0.50
USP2 O75604 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.48
POLB P06746 3/20 0.46
GAA P10253 1/20 0.46
HTT P42858 2/20 0.46
NPC1 O15118 2/20 0.45
ALOX12 P18054 1/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
ALDH1A1 P00352 3/20 0.44
KDM4E B2RXH2 2/20 0.44
LMNA P02545 2/20 0.44
RECQL P46063 1/20 0.44
BLM P54132 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
PIP4K2A P48426 1/20 0.43
HPGD P15428 1/20 0.42
ALOX15 P16050 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
SCHEMBL22360369 0.87 POLB (0.54) MAPTUSP2L3MBTL1POLBNPC1
SCHEMBL22360419 0.87 NOTUM (0.38) MAPTKMT2AMEN1USP2L3MBTL1
SCHEMBL22360381 0.87 NPC1 (0.40) MAPTKMT2AMEN1USP2L3MBTL1
SCHEMBL22360379 0.87 POLB (0.49) MAPTKMT2AL3MBTL1POLBHTT
SCHEMBL22360420 0.86 SMN1; SMN2 (0.55) MAPTKMT2AMEN1L3MBTL1POLB
SCHEMBL22360371 0.85 NPC1 (0.48) MAPTKMT2AL3MBTL1POLBGAA
SCHEMBL22360487 0.84 POLB (0.42) MAPTKMT2AMEN1USP2POLB
SCHEMBL22360494 0.84 L3MBTL1 (0.39) MAPTKMT2AMEN1USP2L3MBTL1
SCHEMBL22360493 0.84 MAPT (0.46) MAPTKMT2AMEN1L3MBTL1POLB
SCHEMBL22360489 0.83 SMN1; SMN2 (0.45) MAPTKMT2AMEN1L3MBTL1NPC1

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