SCHEMBL4748934

SCHEMBL4748934

C=CC(=O)Nc1cc(NC(=O)Nc2ccccc2)cc([N+](=O)[O-])c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TGM2 P21980 2/20 0.62
MEN1 O00255 7/20 0.56
KMT2A Q03164 7/20 0.56
MAPT P10636 4/20 0.56
POLB P06746 2/20 0.56
DDX3X O00571 2/20 0.56
HTT P42858 2/20 0.56
CTDSP1 Q9GZU7 1/20 0.56
CXCR1 P25024 2/20 0.53
CXCR2 P25025 2/20 0.53
GAA P10253 1/20 0.53
ALOX5 P09917 1/20 0.52
LMNA P02545 3/20 0.52
MAPK1 P28482 3/20 0.49
EGFR P00533 1/20 0.48
CA12 O43570 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA5A P35218 1/20 0.48
CA9 Q16790 1/20 0.48

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
SCHEMBL4746373 0.86 ALOX5 (0.71) TGM2MEN1KMT2AMAPTPOLB
SCHEMBL19501282 0.82 TGM2 (0.76) TGM2MEN1KMT2AMAPTPOLB
SCHEMBL5149342 0.81 KMT2A (0.69) TGM2MEN1KMT2AMAPTPOLB
SCHEMBL19501652 0.81 TGM2 (0.85) TGM2KMT2AMAPTLMNAEGFR
SCHEMBL14041475 0.80 TGM2 (0.51) TGM2MEN1KMT2AMAPTGAA
SCHEMBL4746209 0.79 MEN1 (0.60) MEN1KMT2AMAPTPOLBDDX3X
SCHEMBL6129390 0.78 MEN1 (0.90) MEN1KMT2AMAPTPOLBDDX3X
SCHEMBL3919472 0.78 TGM2 (1.00) TGM2MEN1KMT2AMAPTPOLB
Diphenylurea SCHEMBL27302793 0.77 MEN1 (0.81) MEN1KMT2AMAPTPOLBDDX3X
SCHEMBL81209 0.77 TGM2 (1.00) TGM2LMNAEGFRSMN1; SMN2

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-2008122667-A2 UREYLENE DERIVATIVES SCHOOL OF PHARMACY (GB) 2008-10-16 WO disclosed