SCHEMBL31031239

SCHEMBL31031239

Cc1ccc(S(=O)(=O)O[C@H]2CCN(c3ccn4c(c3)nc3ccc(C)cc34)C2)cc1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.44
CYP1A2 P05177 1/20 0.38
HTR6 P50406 2/20 0.35
MAPT P10636 4/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
GAA P10253 1/20 0.35
POLB P06746 2/20 0.35
TP53 P04637 2/20 0.35
RAB9A P51151 1/20 0.35
SUV39H2 Q9H5I1 3/20 0.33
IKBKB O14920 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33
HSD11B1 P28845 1/20 0.33
GPR119 Q8TDV5 1/20 0.32
ACACB O00763 1/20 0.32
NOTUM Q6P988 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 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
SCHEMBL18838768 0.92 CYP2D6 (0.40) CYP2D6CYP1A2HTR6MAPTALDH1A1
SCHEMBL21035280 0.81 MAPT (0.37) MAPTALDH1A1LMNAGAAPOLB
SCHEMBL31031247 0.81 CYP2D6 (0.42) CYP2D6CYP1A2MAPTALDH1A1LMNA
SCHEMBL31031249 0.79 CYP2D6 (0.35) CYP2D6CYP1A2HTR6POLBTP53
SCHEMBL31031211 0.77 CYP2D6 (0.34) CYP2D6CYP1A2ALDH1A1GAAPOLB
SCHEMBL31031230 0.76 CYP2D6 (0.35) CYP2D6CYP1A2POLBTP53RAB9A
SCHEMBL31031237 0.74 CYP2D6 (0.38) CYP2D6CYP1A2MAPTALDH1A1LMNA
SCHEMBL7966928 0.74 CYP2D6 (0.53) CYP2D6CYP1A2MAPTALDH1A1LMNA
SCHEMBL7964234 0.74 CYP2D6 (0.53) CYP2D6CYP1A2MAPTALDH1A1LMNA
SCHEMBL8630790 0.74 CYP2D6 (0.53) CYP2D6CYP1A2MAPTALDH1A1LMNA

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