SCHEMBL15909672

SCHEMBL15909672

CC1(C)c2cc(-c3cc4c5c(ccc6cccc(c65)C4(C)C)c3)ccc2-c2ccc(N(c3ccc(C#N)cc3)c3cccc4ccccc34)cc21

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 2/20 0.36
PGR P06401 2/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
PIM1 P11309 1/20 0.31
HRH3 Q9Y5N1 1/20 0.30

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
SCHEMBL15909631 0.94 HRH3 (0.33) PDK2PGRCA1CA2PIM1
SCHEMBL15909667 0.93 CA1 (0.34) PDK2PGRCA1CA2PIM1
SCHEMBL15909634 0.93 CA1 (0.34) PDK2PGRCA1CA2PIM1
SCHEMBL15909792 0.92 PDK2 (0.36) PDK2PGRCA1CA2PIM1
SCHEMBL15909816 0.91 PDK2 (0.41) PDK2PGRCA1CA2PIM1
SCHEMBL15909642 0.89 PDK2 (0.34) PDK2PGR
SCHEMBL15909632 0.89 CA1 (0.32) PDK2CA1CA2
SCHEMBL15909622 0.89 PDK2 (0.40) PDK2PGRHRH3
SCHEMBL15909674 0.89 HRH3 (0.37) PDK2PGRCA1CA2PIM1
SCHEMBL17849619 0.89

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-20140209872-A1 COMPOUND, ORGANIC LIGHT EMITTING DEVICE INCLUDING THE COMPOUND, AND FLAT DISPLAY DEVICE INCLUDING THE ORGANIC LIGHT EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2014-07-31 US disclosed
US-20140209872-A1 COMPOUND, ORGANIC LIGHT EMITTING DEVICE INCLUDING THE COMPOUND, AND FLAT DISPLAY DEVICE INCLUDING THE ORGANIC LIGHT EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2014-07-31 US disclosed