SCHEMBL5644792

SCHEMBL5644792

CN(Cc1ccccc1)C(=O)c1ccc(F)cc1

nearest known ligand 0.70

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LIMK2 P53671 5/20 0.70
NSD2 O96028 1/20 0.67
KMT2A Q03164 2/20 0.66
MEN1 O00255 1/20 0.66
MLYCD O95822 1/20 0.65
HDAC1 Q13547 1/20 0.61
HDAC6 Q9UBN7 1/20 0.61
MAOA P21397 1/20 0.59
ABL1 P00519 1/20 0.58
LCK P06239 1/20 0.58
LIMK1 P53667 1/20 0.58
TDP1 Q9NUW8 1/20 0.57
NAMPT P43490 1/20 0.57
L3MBTL1 Q9Y468 1/20 0.56
AGER Q15109 1/20 0.56
HPGD P15428 1/20 0.56

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
SCHEMBL5645455 0.93 NSD2 (0.67) LIMK2NSD2KMT2AMEN1MLYCD
SCHEMBL1003665 0.88 KMT2A (0.83) LIMK2KMT2AMEN1MLYCDHDAC1
SCHEMBL2921609 0.85 KMT2A (0.68) LIMK2KMT2AMEN1MLYCDHDAC1
SCHEMBL3455399 0.85 LIMK2 (0.69) LIMK2KMT2AMEN1MLYCDHDAC1
SCHEMBL30131237 0.84 NSD2 (0.68) LIMK2NSD2KMT2AMLYCDHDAC1
SCHEMBL5646698 0.84 NSD2 (0.68) LIMK2NSD2KMT2AMEN1MLYCD
SCHEMBL19630546 0.83 KMT2A (0.66) LIMK2KMT2AMEN1MLYCDHDAC1
SCHEMBL4937857 0.83 HDAC1 (0.66) LIMK2KMT2AMEN1MLYCDHDAC1
SCHEMBL5645193 0.83 MEN1 (0.78) LIMK2KMT2AMEN1MLYCDHDAC1
SCHEMBL14812071 0.82 HDAC1 (0.64) LIMK2KMT2AMEN1MLYCDHDAC1

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
US-7241759-B2 Benzo[1,2,5]thiadiazole compounds JANSSEN PHARMACEUTICA N.V. (BE) 2007-07-10 US disclosed