SCHEMBL25121497

SCHEMBL25121497

CC1(C)c2ccccc2-c2ccc(N(c3ccccc3)c3cc(-c4ccc5c(c4)C4(c6ccccc6-c6ccccc64)c4ccccc4-5)cc(N(c4ccccc4)c4ccc5c(c4)C(C)(C)c4ccccc4-5)c3)cc21

nearest known ligand 0.36

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 12/20 0.36

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
SCHEMBL19625746 1.00 PDK2 (0.36) PDK2
SCHEMBL17780789 1.00 PDK2 (0.36) PDK2
SCHEMBL17780788 0.99 PDK2 (0.36) PDK2
SCHEMBL17780732 0.96 PDK2 (0.37) PDK2
SCHEMBL17780792 0.96 PDK2 (0.34) PDK2
SCHEMBL19625726 0.96 PDK2 (0.39) PDK2
SCHEMBL13104634 0.95 PDK2 (0.39) PDK2
SCHEMBL17740655 0.95 PDK2 (0.39) PDK2
SCHEMBL17780747 0.94 PDK2 (0.39) PDK2
SCHEMBL18998413 0.94 PDK2 (0.39) PDK2

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
US-20230108986-A1 ELECTRONIC DEVICE MERCK PATENT GMBH (DE) 2023-04-06 — — US disclosed
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