SCHEMBL16638907

SCHEMBL16638907

Cc1ncc(OC[C@@]2(c3ccccc3)C[C@H]2CCC(C)(C)[Si](O)(c2ccccc2)c2ccccc2)c(C)n1

nearest known ligand 0.49

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 20/20 0.49
HCRTR2 O43614 20/20 0.49
KCNH2 Q12809 5/20 0.48

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
SCHEMBL2618745 0.92 HCRTR1 (0.43) HCRTR1HCRTR2KCNH2
SCHEMBL16638911 0.91 HCRTR1 (0.50) HCRTR1HCRTR2KCNH2
SCHEMBL2618511 0.88 HCRTR1 (0.43) HCRTR1HCRTR2KCNH2
SCHEMBL2119018 0.81 HCRTR1 (0.49) HCRTR1HCRTR2KCNH2
SCHEMBL2119021 0.81 HCRTR1 (0.49) HCRTR1HCRTR2KCNH2
SCHEMBL2119020 0.81 HCRTR1 (0.49) HCRTR1HCRTR2KCNH2
SCHEMBL16628792 0.81 HCRTR1 (0.58) HCRTR1HCRTR2KCNH2
SCHEMBL2120632 0.81 HCRTR1 (0.58) HCRTR1HCRTR2KCNH2
SCHEMBL2618514 0.79 HCRTR1 (0.36) HCRTR1HCRTR2KCNH2
SCHEMBL10239897 0.78 HCRTR2 (0.57) HCRTR1HCRTR2

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-2626350-B1 CYCLOPROPANE COMPOUND EISAI R&D MAN CO LTD (JP) 2015-04-15 EP disclosed