SCHEMBL7879718

SCHEMBL7879718

CNC(N)=NC(=O)c1cc2ccc(OCCCN3CCCC3)cc2[nH]1

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 3/20 0.54
HRH3 Q9Y5N1 4/20 0.49
PDGFRB P09619 2/20 0.48
PDGFRA P16234 1/20 0.48
DRD2 P14416 5/20 0.47
DRD3 P35462 3/20 0.47
MAOB P27338 6/20 0.47
CHEK2 O96017 1/20 0.44

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
SCHEMBL7879689 0.95 FLT3 (0.59) FLT3PDGFRBPDGFRADRD2DRD3
SCHEMBL7952496 0.85 FLT3 (0.43) FLT3HRH3PDGFRBDRD2DRD3
Hydrochloric Acid SCHEMBL7879744 0.84 FLT3 (0.41) FLT3PDGFRBPDGFRADRD2DRD3
Hydrochloric Acid SCHEMBL8628104 0.84 FLT3 (0.41) FLT3PDGFRBPDGFRADRD2DRD3
SCHEMBL7879728 0.84 FLT3 (0.43) FLT3PDGFRBPDGFRADRD2DRD3
SCHEMBL7873207 0.83 DRD3 (0.41) FLT3HRH3DRD2DRD3MAOB
Hydrochloric Acid SCHEMBL7881414 0.83 FLT3 (0.42) FLT3PDGFRBPDGFRADRD2DRD3
SCHEMBL7884761 0.83 AURKA (0.39) FLT3HRH3PDGFRBMAOBCHEK2
SCHEMBL7881223 0.82 PDGFRB (0.53) FLT3PDGFRBPDGFRADRD2DRD3
SCHEMBL7880874 0.82 RXFP1 (0.42) FLT3HRH3CHEK2

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