SCHEMBL25872113

SCHEMBL25872113

CC1CC2CC(C1)CC(C)(c1ccc(Nc3ccc4c(c3)C(C)(C)c3ccccc3-4)cc1)C2

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 2/20 0.38
NPC1 O15118 1/20 0.32
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
EPHX2 P34913 1/20 0.31

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
SCHEMBL22815548 0.87 NPC1 (0.44) PDK2NPC1LMNAMAPTEPHX2
SCHEMBL23680134 0.84 PDK2 (0.39) PDK2
SCHEMBL27393078 0.84 PDK2 (0.39) PDK2LMNAMAPT
SCHEMBL24969738 0.81 PDK2 (0.39) PDK2NPC1LMNAMAPTEPHX2
SCHEMBL27382638 0.79 PDK2 (0.34) PDK2NPC1LMNAMAPTEPHX2
SCHEMBL22815627 0.78 MAPT (0.40) NPC1LMNAMAPTEPHX2
SCHEMBL782290 0.77 PDK2 (0.51) PDK2MAPT
SCHEMBL12950969 0.77 PDK2 (0.51) PDK2MAPT
SCHEMBL29462256 0.77 PDK2 (0.51) PDK2MAPT
SCHEMBL23600813 0.77 NPC1 (0.41) PDK2NPC1LMNAMAPTEPHX2

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-11711973-B2 Organic electronic device DUK SAN NEOLUX CO., LTD. (KR) 2023-07-25 US disclosed