SCHEMBL8337356

SCHEMBL8337356

O=C1CCC(=O)N1CCOc1cccc(CN[C@@H]2CNCCC2c2ccc(OCCCOCc3ccccc3F)cc2)c1

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
REN P00797 19/20 0.56
KDM1A O60341 1/20 0.41
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41

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
SCHEMBL8336933 1.00 REN (0.56) RENKDM1AMAOAMAOB
SCHEMBL6229997 1.00 REN (0.56) RENKDM1AMAOAMAOB
SCHEMBL6233320 0.90 REN (0.53) RENKDM1AMAOAMAOB
SCHEMBL8336941 0.90 REN (0.53) RENKDM1AMAOAMAOB
SCHEMBL8337360 0.90 REN (0.53) RENKDM1AMAOAMAOB
SCHEMBL8335652 0.85 REN (0.60) RENKDM1AMAOAMAOB
SCHEMBL5779931 0.85 REN (0.60) RENKDM1AMAOAMAOB
SCHEMBL8334775 0.85 REN (0.60) RENKDM1AMAOAMAOB
SCHEMBL8339859 0.80 REN (0.63) RENKDM1AMAOAMAOB
SCHEMBL8339861 0.80 REN (0.63) RENKDM1AMAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004089903-A9 PIPERIDINE DERIVATIVES AS RENIN INHIBITORS FOR THE TREATMENT OF HYPERTENSION WARNER LAMBERT CO (US) 2005-10-27 WO disclosed