SCHEMBL10283299

SCHEMBL10283299

COCCCOc1cc(N(C(=O)[C@@H]2CCCNC2)C2CC2)ccc1C(C)=O

nearest known ligand 0.57

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
REN P00797 19/20 0.57
CDK9 P50750 1/20 0.40

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
SCHEMBL10282959 0.89 REN (0.59) RENCDK9
SCHEMBL1911386 0.86 REN (0.56) RENCDK9
SCHEMBL1911364 0.85 REN (0.56) RENCDK9
SCHEMBL89706 0.78 REN (0.57) REN
SCHEMBL10282964 0.78 USP30 (0.39) REN
SCHEMBL90559 0.78 REN (0.54) REN
SCHEMBL89618 0.77 REN (0.42) REN
SCHEMBL1911408 0.76 REN (0.55) REN
SCHEMBL1911417 0.75 HPGD (0.46) REN
SCHEMBL1911411 0.75 REN (0.54) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2420491-A1 3 , 5-substitued piperidine compounds as renin inhibitors Novartis AG (CH) 2012-02-22 EP disclosed