SCHEMBL31031217

SCHEMBL31031217

Cc1ccc2c(c1)nc1cc(N3CC([18F])C3)ccn12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR3E A5X5Y0 2/20 0.40
HTR3B O95264 2/20 0.40
HTR3A P46098 2/20 0.40
HTR3D Q70Z44 2/20 0.40
HTR3C Q8WXA8 2/20 0.40
HTR1A P08908 1/20 0.36
PDE10A Q9Y233 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
ALDH1A1 P00352 3/20 0.32
KDM4E B2RXH2 2/20 0.32
POLB P06746 2/20 0.32
IRAK4 Q9NWZ3 1/20 0.32
TP53 P04637 1/20 0.32
RAB9A P51151 1/20 0.32
ALOX5 P09917 1/20 0.32
PIK3CA P42336 1/20 0.32
PIK3CB P42338 1/20 0.32
PIK3CG P48736 1/20 0.32
LMNA P02545 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
SCHEMBL31031221 1.00 HTR3E (0.40) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL20515380 0.90 IKBKB (0.40) MEN1KMT2AALDH1A1KDM4EPOLB
SCHEMBL18838764 0.90 IKBKB (0.40) MEN1KMT2AALDH1A1KDM4EPOLB
SCHEMBL31031228 0.85 ALDH1A1 (0.32) ALDH1A1KDM4ETP53RAB9APIK3CA
SCHEMBL31031231 0.85 KDM4E (0.32) ALDH1A1KDM4EGLAGAA
SCHEMBL31031244 0.84 KCNH2 (0.34)
SCHEMBL31031220 0.81
SCHEMBL31031224 0.81 KDM4E (0.40) ALDH1A1KDM4EGLAGAA
SCHEMBL31031256 0.80 KDM4E (0.37) ALDH1A1KDM4EGLAGAA
SCHEMBL31031252 0.79 LRRK2 (0.48) PIK3CAPIK3CBPIK3CGGSK3B

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