SCHEMBL28485658

SCHEMBL28485658

CONC(=O)c1cccc2c(Br)cccc12

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 8/20 0.61
MEN1 O00255 7/20 0.61
AHR P35869 1/20 0.61
PRNP P04156 1/20 0.49
MAPT P10636 1/20 0.43
MMP3 P08254 1/20 0.42
HDAC8 Q9BY41 1/20 0.42
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
PLK1 P53350 2/20 0.41

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
SCHEMBL13527529 0.82 RAB9A (0.53) KMT2AMEN1MAPTNPC1RAB9A
SCHEMBL8185833 0.81 KMT2A (0.63) KMT2AMEN1AHRPRNPMAPT
SCHEMBL2646933 0.81 KMT2A (0.57) KMT2AMEN1AHRPRNP
SCHEMBL29583255 0.81 KMT2A (0.57) KMT2AMEN1AHRPRNP
SCHEMBL10586996 0.79 PLK1 (0.66) KMT2AMEN1MAPTMMP3HDAC8
SCHEMBL10635530 0.78 KMT2A (0.56) KMT2AMEN1AHRPRNPMAPT
SCHEMBL1294284 0.74 KMT2A (0.59) KMT2AMEN1AHRPRNPMAPT
SCHEMBL5772703 0.74 PRNP (0.58) KMT2AMEN1AHRPRNPMAPT
SCHEMBL30530505 0.74 KMT2A (0.59) KMT2AMEN1AHRPRNPMAPT
SCHEMBL7838770 0.73 KMT2A (0.54) KMT2AMEN1AHRPRNPMAPT

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
CN-108314630-B Oxime ether derivative and preparation method and application thereof 广西民族大学 2020-11-06 CN claimed