SCHEMBL19718263

SCHEMBL19718263

CC1(C)c2cc(-c3ccccc3)ccc2-c2ccc([Si](C)(c3ccc4c(c3)C(C)(C)c3cc(-c5ccccc5)ccc3-4)c3ccc4c(c3)C(C)(C)c3cc(-c5ccccc5)ccc3-4)cc21

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 13/20 0.45
▸ PGR P06401 4/20 0.39
▸ CTSD P07339 1/20 0.38
▸ BACE1 P56817 1/20 0.38
▸ TDP2 O95551 1/20 0.36

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
SCHEMBL19718264 0.87 PDK2 (0.46) PDK2
SCHEMBL13766200 0.84 PDK2 (0.42) PDK2PGR
SCHEMBL13766196 0.83 PDK2 (0.44) PDK2PGR
SCHEMBL19704586 0.83 PDK2 (0.37) PDK2PGR
SCHEMBL7141200 0.83 PDK2 (0.49) PDK2PGRTDP2
SCHEMBL13766197 0.82 PDK2 (0.40) PDK2
SCHEMBL30297640 0.81 PDK2 (0.53) PDK2PGR
SCHEMBL30714711 0.81 PDK2 (0.56) PDK2TDP2
SCHEMBL29549175 0.81 PDK2 (0.56) PDK2TDP2
SCHEMBL12520490 0.81 PDK2 (0.56) PDK2TDP2

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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