SCHEMBL24166390

SCHEMBL24166390

CC(=N)c1ccc2c(c1)-c1c(ccc3c1C(C)(C)c1ccccc1-3)C2(C)C

nearest known ligand 0.37

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 13/20 0.35
S100A4 P26447 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
SCHEMBL24570534 0.82 HTR2A (0.37) PDK2
SCHEMBL22920723 0.78 PDK2 (0.44) PDK2S100A4
SCHEMBL25938477 0.74 MLNR (0.31)
SCHEMBL22920934 0.74 PDK2 (0.43) PDK2S100A4
SCHEMBL24871191 0.74 PDK2 (0.43) PDK2
SCHEMBL22920804 0.73 PDK2 (0.41) PDK2
SCHEMBL19196027 0.70 PDK2 (0.39) PDK2
SCHEMBL17345727 0.70 PRSS1 (0.44) PDK2
SCHEMBL28538500 0.70 PDK2 (0.41) PDK2S100A4
SCHEMBL30450957 0.70 PDK2 (0.41) PDK2S100A4

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-2022004994-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE COMPRISING SAME 덕산네오룩스 주식회사 2022-01-06 WO disclosed