SCHEMBL25821302

SCHEMBL25821302

C1=CCC(c2cc(-c3ccccc3)cc(-c3nc(-c4cc(-c5ccccc5)cc(-c5ccccc5)c4)nc(-c4ccc5c(c4)C4(c6ccccc6-c6ccccc64)c4ccccc4-5)n3)c2)C=C1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 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
SCHEMBL22001427 0.94 MEN1 (0.32) PDK2
SCHEMBL24741537 0.92 PDK2 (0.33) PDK2
SCHEMBL26716695 0.92 PDK2 (0.33) PDK2
SCHEMBL21231117 0.92 PDK2 (0.33) PDK2
SCHEMBL24039248 0.91 PDK2 (0.32) PDK2
SCHEMBL21845616 0.91 PDK2 (0.32) PDK2
SCHEMBL12187293 0.88 PDK2 (0.32) PDK2
SCHEMBL13191070 0.88
SCHEMBL19527030 0.87 PDK2 (0.34) PDK2
SCHEMBL13190924 0.86

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
EP-3762387-B1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2023-07-12 EP disclosed