SCHEMBL7825568

SCHEMBL7825568

NC(N)=NC(=O)c1cccc(-n2cccc2/C=N/O)c1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 9/20 0.70
L3MBTL1 Q9Y468 9/20 0.70
TDP1 Q9NUW8 9/20 0.70
APEX1 P27695 6/20 0.70
RECQL P46063 6/20 0.70
MAPT P10636 4/20 0.70
CTDSP1 Q9GZU7 3/20 0.70
NSD2 O96028 2/20 0.70
PTPN7 P35236 2/20 0.70
NR4A1 P22736 1/20 0.70
MAPK1 P28482 1/20 0.70
HSD17B10 Q99714 1/20 0.70
LMNA P02545 2/20 0.48
KMT2A Q03164 5/20 0.47
HTT P42858 2/20 0.47
MEN1 O00255 4/20 0.44
KDM4E B2RXH2 3/20 0.44
ALDH1A1 P00352 2/20 0.44
PKM P14618 2/20 0.39
SLC9A1 P19634 2/20 0.38

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
SCHEMBL1389018 1.00 POLB (0.70) POLBL3MBTL1TDP1APEX1RECQL
SCHEMBL1389017 1.00 POLB (0.70) POLBL3MBTL1TDP1APEX1RECQL
Hydrochloric Acid SCHEMBL7828403 0.99 POLB (0.69) POLBL3MBTL1TDP1APEX1RECQL
Hydrochloric Acid SCHEMBL7827711 0.99 POLB (0.69) POLBL3MBTL1TDP1APEX1RECQL
Hydrochloric Acid SCHEMBL7827708 0.99 POLB (0.69) POLBL3MBTL1TDP1APEX1RECQL
SCHEMBL7826126 0.83 POLB (0.51) POLBL3MBTL1TDP1APEX1RECQL
SCHEMBL7826130 0.83 POLB (0.51) POLBL3MBTL1TDP1APEX1RECQL
SCHEMBL2114364 0.83 POLB (1.00) POLBL3MBTL1TDP1APEX1RECQL
SCHEMBL2114368 0.83 POLB (1.00) POLBL3MBTL1TDP1APEX1RECQL
SCHEMBL3418447 0.83 POLB (1.00) POLBL3MBTL1TDP1APEX1RECQL

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0699185-B1 GUANIDINE DERIVATIVES AS INHIBITORS OF Na+ /H+ EXCHANGE IN CELLS FUJISAWA PHARMACEUTICAL CO (JP) 2001-09-05 EP disclosed
EP-0699185-A1 GUANIDINE DERIVATIVES AS INHIBITORS OF Na+ /H+ EXCHANGE IN CELLS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-03-06 EP disclosed
WO-1994026709-A1 GUANIDINE DERIVATIVES AS INHIBITORS OF Na+/H+ EXCHANGE IN CELLS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-11-24 WO disclosed