SCHEMBL30363396

SCHEMBL30363396

CC1(C)c2ccccc2-c2cc(Br)cc(Cl)c21

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PGR P06401 7/20 0.41
PDK2 Q15119 9/20 0.35
S100A4 P26447 1/20 0.33
NPSR1 Q6W5P4 1/20 0.32

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
SCHEMBL24561794 1.00 PGR (0.41) PGRPDK2S100A4NPSR1
SCHEMBL28564318 0.83 PGR (0.47) PGRPDK2NPSR1
SCHEMBL13002032 0.83 PGR (0.37) PGRPDK2S100A4NPSR1
SCHEMBL17987533 0.80 PGR (0.35) PGRPDK2NPSR1
SCHEMBL24156027 0.78 PDK2 (0.53) PGRPDK2S100A4
SCHEMBL22920777 0.78 PGR (0.42) PGRPDK2
SCHEMBL20806377 0.78 PGR (0.43) PGRPDK2NPSR1
SCHEMBL23620642 0.77 PGR (0.46) PGRPDK2
SCHEMBL24731041 0.77 GABRA1 (0.35) PGRPDK2
SCHEMBL24561570 0.77 PGR (0.44) PGRPDK2S100A4

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
CN-115989725-A Compound and organic light emitting device including the same 株式会社LG化学 2023-04-18 CN disclosed