SCHEMBL19704581

SCHEMBL19704581

CC(C)CC1(CC(C)C)c2ccccc2-c2ccc([Si](C)(c3ccc4c(c3)C(CC(C)C)(CC(C)C)c3ccccc3-4)c3ccc4c(c3)C(CC(C)C)(CC(C)C)c3ccccc3-4)cc21

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 17/20 0.39
▸ APEX1 P27695 1/20 0.32
▸ KCNQ2 O43526 1/20 0.31
▸ ELANE P08246 1/20 0.31

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 0.83 PDK2 (0.38) PDK2APEX1KCNQ2
SCHEMBL6060609 0.82 APEX1 (0.42) PDK2APEX1KCNQ2ELANE
SCHEMBL19704585 0.80 APEX1 (0.39) PDK2APEX1KCNQ2
SCHEMBL19718484 0.79 PDK2 (0.33) PDK2
SCHEMBL19718262 0.79 PDK2 (0.37) PDK2
Hydrochloric Acid SCHEMBL27969289 0.78 PDK2 (0.46) PDK2APEX1KCNQ2ELANE
SCHEMBL14174134 0.77 PDK2 (0.45) PDK2APEX1ELANE
SCHEMBL19718513 0.76 PDK2 (0.36) PDK2APEX1ELANE
SCHEMBL19704586 0.74 PDK2 (0.37) PDK2
SCHEMBL17358869 0.74 PDK2 (0.40) PDK2APEX1ELANE

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 3 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
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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