SCHEMBL26438409

SCHEMBL26438409

CC1(C)c2ccc(Br)cc2-c2ccccc2C1(C)O

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 14/20 0.47
PARP1 P09874 1/20 0.38
PTPRC P08575 1/20 0.37
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA4 P22748 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36
TDP1 Q9NUW8 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
PDE4B Q07343 1/20 0.35
THRB P10828 1/20 0.34

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
SCHEMBL26438407 1.00 PDK2 (0.47) PDK2PARP1PTPRCCA1CA2
SCHEMBL26438412 0.91 PDK2 (0.51) PDK2PARP1PTPRCCA1CA2
SCHEMBL23923645 0.88 PDK2 (0.46) PDK2PARP1PTPRCTDP1L3MBTL1
SCHEMBL29387565 0.88 PDK2 (0.46) PDK2PARP1PTPRCTDP1L3MBTL1
SCHEMBL26118306 0.84 PDK2 (0.51) PDK2PARP1PTPRCCA1CA2
SCHEMBL23936829 0.84 PDK2 (0.46) PDK2TDP1THRB
SCHEMBL3742800 0.82 CA1 (0.45) PDK2PARP1PTPRCCA1CA2
SCHEMBL19757718 0.81 PDK2 (0.60) PDK2PARP1PTPRCCA1CA2
SCHEMBL806937 0.80 PDK2 (0.46) PDK2PARP1PTPRCTDP1L3MBTL1
SCHEMBL29564362 0.80 PDK2 (0.46) PDK2PARP1PTPRCTDP1L3MBTL1

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-20230128431-A1 PLURALITY OF HOST MATERIALS AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2023-04-27 US disclosed
US-20230128431-A1 PLURALITY OF HOST MATERIALS AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2023-04-27 US disclosed