SCHEMBL30954522

SCHEMBL30954522

CC(C)(C)[Si](OCC1Cn2c(cc3ncccc32)C(=O)N1C1CC1)(c1ccccc1)c1ccccc1

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SMYD2 Q9NRG4 3/20 0.34
PDE4A P27815 3/20 0.32
TNKS O95271 2/20 0.31
TNKS2 Q9H2K2 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
SCHEMBL30954500 1.00 SMYD2 (0.34) SMYD2PDE4ATNKSTNKS2
SCHEMBL30954504 0.80 SMYD2 (0.35) SMYD2
SCHEMBL30954498 0.80 SMYD2 (0.35) SMYD2
SCHEMBL30954527 0.67 SMYD2 (0.32) SMYD2
SCHEMBL30954506 0.67 SMYD2 (0.32) SMYD2
SCHEMBL22554979 0.67 SMYD2 (0.40) SMYD2
SCHEMBL29874244 0.66 PDE4A (0.49) PDE4A
SCHEMBL21292094 0.66 PDE4A (0.49) PDE4A
SCHEMBL30954494 0.66 MAPK1 (0.33) PDE4A
SCHEMBL27312555 0.66 MAPK1 (0.33) PDE4A

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-2024118524-A1 AZAINDOLE COMPOUNDS AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS CEREVEL THERAPEUTICS, LLC (US) 2024-06-06 WO disclosed