SCHEMBL15088934

SCHEMBL15088934

CC1(C)c2ccccc2-c2cc(-c3cccc(N4c5cc6c(cc5-c5ccc(-c7ccccn7)c7cccc4c57)c4cc(-c5ccccn5)ccc4n6-c4cccc(-c5ccc6c(c5)-c5ccccc5C6(C)C)c4)c3)ccc21

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 1/20 0.33

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
SCHEMBL15088918 0.92 DHFR (0.32) PDK2
SCHEMBL15088839 0.90 DHFR (0.32) PDK2
SCHEMBL15089200 0.88 GRM5 (0.36)
SCHEMBL15088919 0.87
SCHEMBL15089175 0.86 HTR1A (0.34)
SCHEMBL15089174 0.86 PDK2 (0.33) PDK2
SCHEMBL15089085 0.85 MAPK14 (0.31)
SCHEMBL15089177 0.84 MAPK14 (0.35)
SCHEMBL15088930 0.84 GRM5 (0.33)
SCHEMBL15089176 0.83 GRM5 (0.35)

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2013100497-A1 ORGANIC LIGHT-EMITTING COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME 주식회사 두산 (KR) 2013-07-04 WO disclosed