SCHEMBL29587737

SCHEMBL29587737

CC1(C)c2cc(Br)ccc2-c2ccc(Br)cc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 1/20 0.44
S100A4 P26447 1/20 0.41
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA4 P22748 1/20 0.39
CA7 P43166 1/20 0.39
CA9 Q16790 1/20 0.39
AKR1A1 P14550 1/20 0.39
AKR1B1 P15121 1/20 0.39
TDP2 O95551 1/20 0.38
PGR P06401 2/20 0.36
PTPRC P08575 1/20 0.35
METAP1 P53582 1/20 0.35
BCL2 P10415 1/20 0.34
MCL1 Q07820 1/20 0.34
HTR2B P41595 1/20 0.34
SIGMAR1 Q99720 1/20 0.34
MALT1 Q9UDY8 1/20 0.33
TGM2 P21980 1/20 0.33
CES1 P23141 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
SCHEMBL29403081 1.00 PDK2 (0.44) PDK2S100A4CA1CA2CA4
SCHEMBL204806 1.00 PDK2 (0.44) PDK2S100A4CA1CA2CA4
SCHEMBL5063493 0.95 PDK2 (0.42) PDK2S100A4CA1CA2CA4
SCHEMBL29294792 0.95 PDK2 (0.42) PDK2S100A4CA1CA2CA4
SCHEMBL29458875 0.95 PDK2 (0.42) PDK2S100A4CA1CA2CA4
SCHEMBL5013191 0.95 PDK2 (0.42) PDK2S100A4CA1CA2CA4
SCHEMBL10227289 0.93 PDK2 (0.41) PDK2S100A4CA1CA2CA4
SCHEMBL1648023 0.91 PDK2 (0.40) PDK2S100A4CA1CA2CA4
SCHEMBL1649907 0.91 PDK2 (0.40) PDK2S100A4CA1CA2CA4
SCHEMBL14508381 0.91 PDK2 (0.40) PDK2S100A4CA1CA2CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119899387-A Method for preparing polycarbosilane by using Grignard reagent 汕头大学 2025-04-29 CN claimed
CN-119899387-A Method for preparing polycarbosilane by using Grignard reagent 汕头大学 2025-04-29 CN disclosed
CN-119842050-A Method for preparing conjugated polymer 汕头大学 2025-04-18 CN disclosed
CN-119371643-B Method for preparing fluorescent polymer, fluorescent polymer product obtained by method and application 汕头大学 2025-04-04 CN disclosed
CN-119371643-A Method for preparing fluorescent polymer, fluorescent polymer product obtained by method and application 汕头大学 2025-01-28 CN disclosed
CN-114409645-B Molecule based on saccharin derivative and preparation method and application thereof 华南协同创新研究院 2024-07-12 CN disclosed
CN-114409645-A Molecule based on saccharin derivative and preparation method and application thereof 华南协同创新研究院 2022-04-29 CN disclosed