SCHEMBL3886407

SCHEMBL3886407

CCC1(CC)c2ccccc2-c2ccc(-c3c4ccccc4c(-c4ccc5c(c4)C(CC)(CC)c4ccccc4-5)c4cc(C)ccc34)cc21

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 11/20 0.39
ELANE P08246 1/20 0.31
ALDH1A1 P00352 1/20 0.31
THRB P10828 1/20 0.31
HPGD P15428 1/20 0.31
PGR P06401 1/20 0.30
RORA P35398 1/20 0.30
RORC P51449 1/20 0.30
RORB Q92753 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
SCHEMBL6683913 0.90 PDK2 (0.38) PDK2PGR
SCHEMBL6684790 0.89 PDK2 (0.37) PDK2
SCHEMBL6680358 0.86 PDK2 (0.39) PDK2PGR
SCHEMBL3887347 0.86 PDK2 (0.39) PDK2
SCHEMBL13936997 0.84 PDK2 (0.40) PDK2
SCHEMBL6680988 0.84 NPC1 (0.35) PDK2ALDH1A1PGRRORARORC
SCHEMBL4370411 0.82 ALOX5 (0.43) PDK2ELANEPGR
SCHEMBL13937001 0.82 PDK2 (0.40) PDK2
SCHEMBL3886412 0.81 PDK2 (0.35) PDK2PGR
SCHEMBL10153158 0.81 PDK2 (0.47) PDK2ALDH1A1HPGD

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-7479330-B2 Anthracene derivatives for organic electroluminescent device AU OPTRONICS CORPORATION (TW) 2009-01-20 US disclosed
US-20060269783-A1 Anthracene derivatives for organic electroluminescent device AU OPTRONICS CORPORATION 2006-11-30 US disclosed