SCHEMBL7257271

SCHEMBL7257271

O=C1CN(CCc2ccoc2)CC2OC3(CCN(c4ccncc4)CC3)CN12

nearest known ligand 0.44

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 19/20 0.44
OPRM1 P35372 17/20 0.42
KCNH2 Q12809 10/20 0.38

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
SCHEMBL7261588 0.91 SIGMAR1 (0.37) SIGMAR1OPRM1KCNH2
SCHEMBL7262985 0.88 SIGMAR1 (0.55) SIGMAR1OPRM1KCNH2
SCHEMBL7261688 0.85 SIGMAR1 (0.41) SIGMAR1OPRM1KCNH2
SCHEMBL7258219 0.84 SIGMAR1 (0.43) SIGMAR1OPRM1KCNH2
SCHEMBL7262094 0.83 SIGMAR1 (0.42) SIGMAR1OPRM1KCNH2
SCHEMBL7263030 0.83 SIGMAR1 (0.49) SIGMAR1OPRM1KCNH2
SCHEMBL7258041 0.82 SIGMAR1 (0.48) SIGMAR1OPRM1KCNH2
SCHEMBL7262783 0.81 SIGMAR1 (0.50) SIGMAR1OPRM1KCNH2
SCHEMBL7262982 0.81 SIGMAR1 (0.45) SIGMAR1OPRM1KCNH2
SCHEMBL7257211 0.81 LSS (0.39) SIGMAR1OPRM1

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-1346994-A1 CHOLESTEROL BIOSYNTHESIS INHIBITORS CONTAINING AS THE ACTIVE INGREDIENT TRICYCLIC SPIRO COMPOUNDS MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2003-09-24 EP disclosed