SCHEMBL7084097

SCHEMBL7084097

c1cncc(C2CCNCC2OCc2ccc3ccccc3c2)c1

nearest known ligand 0.69

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
REN P00797 19/20 0.69
SLC6A2 P23975 1/20 0.56
SLC6A4 P31645 1/20 0.56
SLC6A3 Q01959 1/20 0.56
KCNH2 Q12809 1/20 0.56

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
SCHEMBL8295347 0.90 REN (0.66) REN
Hydrochloric Acid SCHEMBL2811841 0.89 REN (0.65) REN
Hydrochloric Acid SCHEMBL2811839 0.89 REN (0.65) REN
Hydrochloric Acid SCHEMBL5493585 0.89 REN (0.65) REN
SCHEMBL6042202 0.88 REN (0.75) REN
SCHEMBL6959229 0.88 REN (0.83) RENSLC6A2SLC6A4SLC6A3KCNH2
Hydrochloric Acid SCHEMBL8208438 0.87 REN (0.81) REN
SCHEMBL6960173 0.85 REN (0.83) RENSLC6A2SLC6A4SLC6A3KCNH2
SCHEMBL8296545 0.84 REN (0.64) REN
SCHEMBL6042292 0.84 REN (0.82) REN

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-0863875-B1 NEW 4-(OXYALKOXYPHENYL)-3-OXY-PIPERIDINES FOR TREATING HEART AND KIDNEY INSUFFICIENCY HOFFMANN LA ROCHE (CH) 2003-06-04 EP disclosed
US-6150526-A Piperidine derivative having renin inhibiting activity HOFFMANN-LA ROCHE INC. (US) 2000-11-21 US disclosed
US-6051712-A PREVENTION OF HIGH BLOOD PRESSURE AND CARDIAC INSUFFICIENCY, AS WELL AS GLAUCOMA, CARDIAC INFARCT, KIDNEY INSUFFICIENCY AND RESTENOSIS HOFFMANN-LA ROCHE INC. (US) 2000-04-18 US disclosed