SCHEMBL23936652

SCHEMBL23936652

CC1(C)c2cc(N(c3ccc4c(c3)C(C)(C)C(C)(C)c3ccccc3-4)c3ccc4ccccc4c3)ccc2-c2c1ccc1ccccc21

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 1/20 0.31
DNMT1 P26358 1/20 0.31
SLC6A2 P23975 1/20 0.30
SLC6A4 P31645 1/20 0.30
SLC6A3 Q01959 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
SCHEMBL23936665 0.95 PDK2 (0.32) PDK2DNMT1
SCHEMBL23936679 0.93 PDK2 (0.31) PDK2
SCHEMBL23936503 0.93 PDK2 (0.34) PDK2DNMT1
SCHEMBL23936065 0.91 PDK2 (0.32) PDK2
SCHEMBL23936658 0.90 PDK2 (0.30) PDK2
SCHEMBL15864533 0.88 DNMT1 (0.35) DNMT1SLC6A2SLC6A4SLC6A3
SCHEMBL19849965 0.88 PDK2 (0.30) PDK2DNMT1
SCHEMBL19849986 0.88 PDK2 (0.30) PDK2DNMT1
SCHEMBL19197449 0.87 SLC6A2 (0.32) DNMT1SLC6A2SLC6A4SLC6A3
SCHEMBL13776729 0.87 SLC6A2 (0.32) DNMT1SLC6A2SLC6A4SLC6A3

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
US-20210328150-A1 ORGANIC ELECTROLUMINESCENT COMPOUND, ORGANIC ELECTROLUMINESCENT MATERIAL COMPRISING THE SAME, AND ORGANIC ELECTROLUMINESCENT DEVICE DUPONT SPECIALTY MATERIALS KOREA LTD. (KR) 2021-10-21 US disclosed