SCHEMBL10935722

SCHEMBL10935722

NP(N)(=O)NC(=O)c1ccc(C(=O)NP(N)(N)=O)c2ccccc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 2/20 0.43
KMT2A Q03164 2/20 0.41
HDAC8 Q9BY41 2/20 0.41
ATM Q13315 1/20 0.41
MMP3 P08254 1/20 0.41
NSD2 O96028 2/20 0.40
CXCR5 P32302 2/20 0.40
MEN1 O00255 1/20 0.39
BRD4 O60885 1/20 0.35
DEGS1 O15121 1/20 0.35
WDR5 P61964 1/20 0.34
HDAC3 O15379 1/20 0.34
HDAC4 P56524 1/20 0.34
HDAC1 Q13547 1/20 0.34
HDAC7 Q8WUI4 1/20 0.34
HDAC2 Q92769 1/20 0.34
HDAC10 Q969S8 1/20 0.34
HDAC11 Q96DB2 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
HDAC9 Q9UKV0 1/20 0.34

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
SCHEMBL8652751 0.76 GAA (0.58) KMT2AMEN1NPC1RAB9A
Tolfamide SCHEMBL11435090 0.76 HPGD (0.55) NPC1RAB9A
Tolfamide SCHEMBL29388345 0.76 HPGD (0.55) NPC1RAB9A
SCHEMBL466508 0.76 MAPT (0.52) PLK1KMT2AHDAC8ATMMMP3
SCHEMBL1504747 0.74 HDAC3 (0.54) KMT2AHDAC8MEN1HDAC3HDAC1
SCHEMBL8653738 0.72 LMNA (0.64) HDAC3HDAC1
SCHEMBL13520263 0.71 PLK1 (0.72) PLK1HDAC8MMP3NSD2BRD4
SCHEMBL10930839 0.71 PTPN1 (0.51) PLK1HDAC8MMP3DEGS1HDAC3
SCHEMBL8712796 0.71 CTSD (0.68) KMT2AMEN1KDM4E
SCHEMBL8631381 0.71 OGG1 (0.43) KMT2AHDAC8ATMMEN1HDAC1

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-4518413-A Poly-phosphorodiamide urease inhibitors and urease inhibited urea based fertilizer compositions ALLIED CORPORATION (US) 1985-05-21 US disclosed