SCHEMBL5644480

SCHEMBL5644480

CN(Cc1ccccc1)C(=O)c1cccc(Cl)c1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.79
MEN1 O00255 2/20 0.79
GAA P10253 2/20 0.66
LIMK2 P53671 1/20 0.61
TP53 P04637 1/20 0.58
TMEM97 Q5BJF2 1/20 0.56
SIGMAR1 Q99720 1/20 0.56
HPGD P15428 2/20 0.56
ALDH1A1 P00352 2/20 0.56
TSHR P16473 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.55
HSP90AA1 P07900 1/20 0.55
HSD17B1 P14061 1/20 0.55
HSD17B2 P37059 1/20 0.55
HTT P42858 1/20 0.54
SIRT2 Q8IXJ6 1/20 0.54
PIN1 Q13526 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
HDAC1 Q13547 1/20 0.54
HDAC6 Q9UBN7 1/20 0.54

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
SCHEMBL8242118 0.85 MEN1 (0.57) KMT2AMEN1GAALIMK2TMEM97
SCHEMBL13229125 0.84 KMT2A (0.90) KMT2AMEN1GAAHPGDALDH1A1
SCHEMBL18773963 0.84 MEN1 (0.60) KMT2AMEN1GAALIMK2TP53
SCHEMBL15676742 0.84 MEN1 (0.60) KMT2AMEN1GAALIMK2TP53
SCHEMBL1003665 0.84 KMT2A (0.83) KMT2AMEN1GAALIMK2HPGD
SCHEMBL18186542 0.83 KMT2A (0.82) KMT2AMEN1GAAHPGDALDH1A1
SCHEMBL2228587 0.83 KMT2A (0.82) KMT2AMEN1GAALIMK2HPGD
SCHEMBL15676710 0.83 KMT2A (0.82) KMT2AMEN1GAAHPGDALDH1A1
SCHEMBL1196932 0.83 MEN1 (0.58) KMT2AMEN1GAALIMK2TP53
SCHEMBL5643137 0.83 HDAC1 (0.66) KMT2AMEN1LIMK2ALDH1A1HSP90AA1

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