Sugi Predict

Sugi Predict / Compounds / SCHEMBL15081536

SCHEMBL15081536

SCHEMBL15081536

CC1(C)c2ccccc2-c2ccc(N(c3ccccc3)c3ccc4c(-c5cccc6ccccc56)c5cc(N(c6ccccc6)c6ccc7c(c6)C(C)(C)c6cc(-c8ccccc8)ccc6-7)ccc5c(-c5ccccc5)c4c3)cc21

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 3/20 0.33
▸ CA12 O43570 3/20 0.31
▸ CA1 P00915 3/20 0.31
▸ CA2 P00918 3/20 0.31
▸ CA9 Q16790 3/20 0.31
▸ SLC6A9 P48067 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
SCHEMBL15081565 0.96 PDK2 (0.32) PDK2
SCHEMBL12770684 0.96 CA12 (0.33) PDK2CA12CA1CA2CA9
SCHEMBL15081558 0.95 PIM1 (0.31) —
SCHEMBL13333569 0.94 CA12 (0.30) CA12CA1CA2CA9
SCHEMBL13333895 0.94 CA12 (0.30) CA12CA1CA2CA9
SCHEMBL14463298 0.93 PDK2 (0.34) PDK2CA12CA1CA2CA9
SCHEMBL15237236 0.92 PDK2 (0.33) PDK2CA12CA1CA2CA9
SCHEMBL12014676 0.92 PDK2 (0.34) PDK2
SCHEMBL12770631 0.92 PDK2 (0.38) PDK2
SCHEMBL15081534 0.92 PDK2 (0.38) PDK2

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-20130168645-A1 GREEN ORGANIC LIGHT-EMITTING DIODE, AND FLAT PANEL DISPLAY DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2013-07-04 — — US disclosed
US-20130168645-A1 GREEN ORGANIC LIGHT-EMITTING DIODE, AND FLAT PANEL DISPLAY DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2013-07-04 — — US disclosed
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