SCHEMBL7828228

SCHEMBL7828228

C/C(=N\O)c1cccn1-c1cccc(C(=O)N=C(N)N)c1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 3/20 0.41
NSD2 O96028 1/20 0.41
POLB P06746 1/20 0.41
MAPT P10636 1/20 0.41
NR4A1 P22736 1/20 0.41
APEX1 P27695 1/20 0.41
MAPK1 P28482 1/20 0.41
PTPN7 P35236 1/20 0.41
RECQL P46063 1/20 0.41
HSD17B10 Q99714 1/20 0.41
CTDSP1 Q9GZU7 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
PARP1 P09874 1/20 0.38
PARP15 Q460N3 1/20 0.38
PARP10 Q53GL7 1/20 0.38
HTR2B P41595 5/20 0.36
HTR7 P34969 4/20 0.36

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
SCHEMBL7828230 1.00 SLC9A1 (0.41) SLC9A1NSD2POLBMAPTNR4A1
SCHEMBL7828221 1.00 SLC9A1 (0.41) SLC9A1NSD2POLBMAPTNR4A1
Hydrochloric Acid SCHEMBL7824091 0.99 SLC9A1 (0.41) SLC9A1NSD2POLBMAPTNR4A1
Hydrochloric Acid SCHEMBL7824088 0.99 SLC9A1 (0.41) SLC9A1NSD2POLBMAPTNR4A1
Hydrochloric Acid SCHEMBL7824085 0.99 SLC9A1 (0.41) SLC9A1NSD2POLBMAPTNR4A1
SCHEMBL7823946 0.88 SLC9A1 (0.44) SLC9A1NSD2POLBMAPTNR4A1
Hydrochloric Acid SCHEMBL7823555 0.87 SLC9A1 (0.43) SLC9A1NSD2POLBMAPTNR4A1
SCHEMBL7817151 0.85 SLC9A1 (0.43) SLC9A1NSD2POLBMAPTNR4A1
Hydrochloric Acid SCHEMBL7827127 0.84 HTR2B (0.43) SLC9A1NSD2POLBMAPTNR4A1
SCHEMBL7825105 0.84 POLB (0.48) SLC9A1NSD2POLBMAPTNR4A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1080257-C Guanidine derivatives as inhibitors of Na+/H+ exchange in cells FUJISAWA PHARMACEUTICAL CO (JP) 2002-03-06 CN disclosed
EP-0699185-B1 GUANIDINE DERIVATIVES AS INHIBITORS OF Na+ /H+ EXCHANGE IN CELLS FUJISAWA PHARMACEUTICAL CO (JP) 2001-09-05 EP disclosed
CN-1123545-A Guanidine derivatives as inhibitors of Na+/H+ exchange in cells FUJISAWA PHARMACEUTICAL CO (JP) 1996-05-29 CN disclosed
WO-1994026709-A1 GUANIDINE DERIVATIVES AS INHIBITORS OF Na+/H+ EXCHANGE IN CELLS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-11-24 WO disclosed