SCHEMBL7882192

SCHEMBL7882192

CNC(N)=NC(=O)c1cc2c(OC)ccc(OCCCN(C)C)c2[nH]1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.44
HPGD P15428 1/20 0.44
BCHE P06276 5/20 0.38
ACHE P22303 4/20 0.38
KMT2A Q03164 4/20 0.38
MEN1 O00255 3/20 0.38
POLB P06746 1/20 0.38
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
KLF5 Q13887 2/20 0.37
TLR9 Q9NR96 1/20 0.36
TLR8 Q9NR97 1/20 0.36
TLR7 Q9NYK1 1/20 0.36
TP53 P04637 1/20 0.36
HSD17B10 Q99714 1/20 0.36
HRH3 Q9Y5N1 2/20 0.36
DRD2 P14416 1/20 0.36
DRD3 P35462 1/20 0.36
THRA P10827 1/20 0.36
THRB P10828 1/20 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
Hydrochloric Acid SCHEMBL7881522 0.99 KDM4E (0.43) KDM4EHPGDBCHEACHEKMT2A
SCHEMBL7881951 0.90 KDM4E (0.42) KDM4EHPGDBCHEACHEKMT2A
SCHEMBL7879653 0.90 ALDH1A1 (0.38) KDM4EHSD17B10HRH3THRATHRB
SCHEMBL7884650 0.89 KDM4E (0.38) KDM4EHPGDTLR9TLR8TLR7
Hydrochloric Acid SCHEMBL7881182 0.89 ALDH1A1 (0.37) KDM4EHSD17B10HRH3THRATHRB
SCHEMBL7882346 0.89 KDM4E (0.46) KDM4EHPGDKMT2AMEN1POLB
Hydrochloric Acid SCHEMBL8633729 0.88 KDM4E (0.39) KDM4EHPGDKMT2AMEN1HRH3
Hydrochloric Acid SCHEMBL7884769 0.88 KDM4E (0.39) KDM4EHPGDKMT2AMEN1HRH3
Hydrochloric Acid SCHEMBL7880760 0.87 THRA (0.38) KDM4EHRH3THRATHRBALDH1A1
Hydrochloric Acid SCHEMBL7879941 0.84 KDM4E (0.38) KDM4EHRH3DRD2DRD3ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6248772-B1 HYPOTENSIVE AGENTS; ANTIARRHYTHMIA AGENTS; ANTIDIABETIC AGENTS; ANTIPROLIFERATIVE AGENTS SUMITOMO PHARMACEUTICALS CO., LTD. (JP) 2001-06-19 US disclosed
US-6169107-B1 USEFUL FOR THE TREATMENT AND PREVENTION OF DISEASES CAUSED BY INCREASED SODIUM/PROTON (NA.SUP.+ /H.SUP.+) EXCHANGER ACTIVITY, FOR EXAMPLE, HYPERTENSION, ARRHYTHMIA, ANGINA PECTORIS, CARDIAC HYPERTROPHY, DIABETES MELLITUS SUMITOMO PHARMACEUTICAL CO., LTD. (JP) 2001-01-02 US disclosed
EP-0622356-B1 Indoloylguanidine derivatives as inhibitors of sodium-hydrogen exchange SUMITOMO PHARMA (JP) 1998-07-01 EP disclosed
EP-0708091-A2 Indoloylguanidine derivatives SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1996-04-24 EP disclosed
EP-0622356-A1 Indoloylguanidine derivatives as inhibitors of sodium-hydrogen exchange SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1994-11-02 EP disclosed