SCHEMBL7827587

SCHEMBL7827587

CN(C)Cc1cccn1-c1cccc(C(=O)N=C(N)N)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 1/20 0.38
PDGFRA P16234 1/20 0.38
FLT1 P17948 1/20 0.38
FLT4 P35916 1/20 0.38
KDR P35968 1/20 0.38
SLC9A1 P19634 4/20 0.38
NSD2 O96028 1/20 0.38
POLB P06746 1/20 0.38
MAPT P10636 1/20 0.38
NR4A1 P22736 1/20 0.38
APEX1 P27695 1/20 0.38
MAPK1 P28482 1/20 0.38
PTPN7 P35236 1/20 0.38
RECQL P46063 1/20 0.38
HSD17B10 Q99714 1/20 0.38
CTDSP1 Q9GZU7 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
HTR2B P41595 7/20 0.35
HTR7 P34969 6/20 0.35

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
Hydrochloric Acid SCHEMBL27378866 0.99 PDGFRB (0.38) PDGFRBPDGFRAFLT1FLT4KDR
Hydrochloric Acid SCHEMBL7823645 0.99 PDGFRB (0.38) PDGFRBPDGFRAFLT1FLT4KDR
SCHEMBL7828944 0.81 POLB (0.41) SLC9A1NSD2POLBMAPTNR4A1
SCHEMBL9065400 0.80 POLB (0.44) SLC9A1NSD2POLBMAPTNR4A1
SCHEMBL9065396 0.80 POLB (0.44) SLC9A1NSD2POLBMAPTNR4A1
SCHEMBL9395941 0.80 SLC9A1 (0.45) SLC9A1NSD2POLBMAPTNR4A1
Hydrochloric Acid SCHEMBL9045263 0.79 POLB (0.44) SLC9A1NSD2POLBMAPTNR4A1
SCHEMBL8699348 0.79 AOC2 (0.40) PDGFRBPDGFRAFLT1FLT4KDR
SCHEMBL7825574 0.79 PDGFRB (0.52) PDGFRBPDGFRAFLT1FLT4KDR
Hydrochloric Acid SCHEMBL7826484 0.79 SLC9A1 (0.44) 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 6 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
US-5824691-A CARDIOVASCULAR, CEREBROVASCULAR, RENAL DISEASES; SHOCK, ARTERIOSCLEROSIS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-10-20 US disclosed
CN-1123545-A Guanidine derivatives as inhibitors of Na+/H+ exchange in cells FUJISAWA PHARMACEUTICAL CO (JP) 1996-05-29 CN 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