SCHEMBL19704585

SCHEMBL19704585

CCCC1(CCC)c2ccccc2-c2ccc([Si](C)(c3ccc4c(c3)C(CCC)(CCC)c3ccccc3-4)c3ccc4c(c3)C(CCC)(CCC)c3ccccc3-4)cc21

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ APEX1 P27695 1/20 0.39
▸ PDK2 Q15119 16/20 0.38
▸ PGR P06401 2/20 0.37
▸ KCNQ2 O43526 1/20 0.32

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
SCHEMBL19704580 0.87 PDK2 (0.38) APEX1PDK2PGRKCNQ2
SCHEMBL1617518 0.81 APEX1 (0.53) APEX1PDK2PGRKCNQ2
SCHEMBL9867937 0.81 APEX1 (0.53) APEX1PDK2PGRKCNQ2
SCHEMBL29370881 0.81 APEX1 (0.53) APEX1PDK2PGRKCNQ2
SCHEMBL9781137 0.80 APEX1 (0.43) APEX1PDK2PGR
SCHEMBL19704581 0.80 PDK2 (0.39) APEX1PDK2KCNQ2
SCHEMBL19718262 0.80 PDK2 (0.37) PDK2
SCHEMBL16265319 0.80 PDK2 (0.41) APEX1PDK2
SCHEMBL8965214 0.78 PDK2 (0.49) APEX1PDK2PGR
SCHEMBL12095465 0.78 PDK2 (0.47) APEX1PDK2PGR

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9845334-B1 High-efficiency organic glass scintillators NATIONAL TECHNOLOGY & ENGINEERING SOLUTIONS OF SANDIA, LLC (US) 2017-12-19 — — US disclosed
US-9845334-B1 High-efficiency organic glass scintillators NATIONAL TECHNOLOGY & ENGINEERING SOLUTIONS OF SANDIA, LLC (US) 2017-12-19 — — US disclosed
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