SCHEMBL7080911

SCHEMBL7080911

CC(C)(C)OC(=O)ON1CCC(c2ccc(CCO)cc2)C(OCc2cc(OCc3ccccc3)c3ccccc3c2)C1

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
REN P00797 13/20 0.37
KLK7 P49862 1/20 0.34
KDM2B Q8NHM5 1/20 0.34
TACR1 P25103 1/20 0.34
LRRK2 Q5S007 1/20 0.33

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
SCHEMBL7084770 0.90 REN (0.35) RENKLK7KDM2BTACR1
SCHEMBL7081010 0.89 KDM2B (0.36) RENKLK7KDM2BTACR1LRRK2
SCHEMBL7077071 0.88 REN (0.34) RENTACR1
SCHEMBL7074773 0.88 REN (0.47) REN
SCHEMBL7076769 0.87 REN (0.45) REN
SCHEMBL7083931 0.87 KDM2B (0.36) KLK7KDM2BTACR1LRRK2
SCHEMBL7079194 0.87 KDM2B (0.37) RENKLK7KDM2BTACR1LRRK2
SCHEMBL7076042 0.85 REN (0.37) RENKLK7KDM2BTACR1
SCHEMBL6043804 0.84 REN (0.39) RENKDM2BLRRK2
SCHEMBL7083194 0.83 REN (0.47) 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-0863875-B1 NEW 4-(OXYALKOXYPHENYL)-3-OXY-PIPERIDINES FOR TREATING HEART AND KIDNEY INSUFFICIENCY HOFFMANN LA ROCHE (CH) 2003-06-04 EP disclosed