SCHEMBL31031232

SCHEMBL31031232

CCc1ccc2c(c1)nc1cc(N3CC(O)C3)ccn12

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 2/20 0.34
HRH4 Q9H3N8 2/20 0.34
HRH3 Q9Y5N1 2/20 0.34
TRPC5 Q9UL62 9/20 0.33
CYP2C9 P11712 2/20 0.33
CYP2C19 P33261 2/20 0.33
CSF1R P07333 2/20 0.32
CYP3A4 P08684 1/20 0.31
SUV39H2 Q9H5I1 1/20 0.31
TRPC4 Q9UBN4 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
SCHEMBL31031244 0.88 KCNH2 (0.34) KCNH2HRH4HRH3TRPC5TRPC4
SCHEMBL31031218 0.81 SUV39H2 (0.34) SUV39H2
SCHEMBL31031212 0.80 ALDH1A1 (0.39) CYP2C9CYP2C19
SCHEMBL31031233 0.79
SCHEMBL31031214 0.78 MAPK8 (0.32)
SCHEMBL31031241 0.77 KDM4E (0.37) SUV39H2
SCHEMBL18838775 0.77 IKBKB (0.40) HRH4HRH3SUV39H2
SCHEMBL31031251 0.74 SUV39H2 (0.35) SUV39H2
SCHEMBL31031221 0.72 HTR3E (0.40)
SCHEMBL31031217 0.72 HTR3E (0.40)

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4658651-A1 NOVEL COMPOUNDS FOR TAU IMAGING Eli Lilly and Company (US) 2025-12-10 EP disclosed
WO-2024163546-A1 NOVEL COMPOUNDS FOR TAU IMAGING ELI LILLY AND COMPANY (US) 2024-08-08 WO disclosed