SCHEMBL30890278

SCHEMBL30890278

CC(C)(C)OC(=O)N1C[C@@H]2CN(c3ccc([N+](=O)[O-])cc3F)C[C@@H]2C1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.52
LMNA P02545 4/20 0.52
MAPT P10636 4/20 0.52
THRB P10828 1/20 0.49
KMT2A Q03164 2/20 0.49
POLB P06746 2/20 0.47
USP30 Q70CQ3 1/20 0.45
SLC6A5 Q9Y345 7/20 0.44
HDAC1 Q13547 1/20 0.44
HDAC2 Q92769 1/20 0.44
SLC6A9 P48067 6/20 0.43
MEN1 O00255 1/20 0.43
MAPK1 P28482 1/20 0.43
DPP4 P27487 1/20 0.43

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
SCHEMBL30890277 1.00 ALDH1A1 (0.52) ALDH1A1LMNAMAPTTHRBKMT2A
SCHEMBL27404998 1.00 ALDH1A1 (0.52) ALDH1A1LMNAMAPTTHRBKMT2A
SCHEMBL29536266 0.86 ALDH1A1 (0.68) ALDH1A1LMNAMAPTTHRBKMT2A
SCHEMBL994347 0.86 ALDH1A1 (0.68) ALDH1A1LMNAMAPTTHRBKMT2A
SCHEMBL25370697 0.86 ALDH1A1 (0.54) ALDH1A1LMNAMAPTTHRBKMT2A
SCHEMBL10035920 0.86 ALDH1A1 (0.56) ALDH1A1LMNAMAPTTHRBKMT2A
SCHEMBL29554755 0.86 ALDH1A1 (0.56) ALDH1A1LMNAMAPTTHRBKMT2A
SCHEMBL14852226 0.85 MAPT (0.59) ALDH1A1LMNAMAPTTHRBKMT2A
SCHEMBL30890258 0.84 ALDH1A1 (0.47) ALDH1A1LMNAMAPTTHRBKMT2A
SCHEMBL31485106 0.84 ALDH1A1 (0.51) ALDH1A1LMNAMAPTTHRBKMT2A

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-2024108009-A1 DYRK/CLK PROTACS AND USES THEREOF ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2024-05-23 WO disclosed