SCHEMBL1037896

SCHEMBL1037896

COCCCOc1cc(CO[C@H]2CN(C(=O)OCc3ccccc3)C[C@@H](O)[C@@H]2c2ccc(OCCCOCc3ccccc3OC)cc2)ccc1OC

nearest known ligand 0.47

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
REN P00797 20/20 0.47

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
SCHEMBL3944040 0.92 REN (0.50) REN
SCHEMBL1039554 0.90 REN (0.47) REN
SCHEMBL14218767 0.90 REN (0.47) REN
SCHEMBL4582262 0.90 REN (0.47) REN
SCHEMBL4608401 0.88 REN (0.49) REN
SCHEMBL4582060 0.88 REN (0.49) REN
SCHEMBL4582067 0.88 REN (0.49) REN
SCHEMBL4582947 0.87 REN (0.48) REN
SCHEMBL4611575 0.87 REN (0.48) REN
SCHEMBL14218762 0.87 REN (0.48) 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-2049514-B1 NITRATE ESTERS OF PIPERIDINES NOVARTIS AG (CH) 2011-01-26 EP disclosed
EP-1908762-A2 Organic compounds Speedel Experimenta AG (CH) 2008-04-09 EP disclosed
EP-1908761-A1 Organic compounds Speedel Experimenta AG (CH) 2008-04-09 EP disclosed