SCHEMBL31333447

SCHEMBL31333447

CC(C)(C)OC(=O)NC1CCN(CC2CCN(c3ccc([N+](=O)[O-])c(O)c3)CC2)CC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 6/20 0.47
SIRT6 Q8N6T7 1/20 0.46
MAPT P10636 4/20 0.43
THRB P10828 1/20 0.43
PKM P14618 1/20 0.43
KCNA3 P22001 1/20 0.41
SUV39H2 Q9H5I1 2/20 0.41
ALDH1A1 P00352 2/20 0.40
DRD3 P35462 2/20 0.39
USP14 P54578 1/20 0.39
LMNA P02545 1/20 0.39
CKS1B P61024 1/20 0.39
SKP1 P63208 1/20 0.39
SKP2 Q13309 1/20 0.39
CHRM4 P08173 1/20 0.39
JAK2 O60674 2/20 0.38
JAK1 P23458 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
MLNR O43193 1/20 0.38

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
SCHEMBL31334881 0.86 SIRT6 (0.48) SIRT6MAPTTHRBPKMALDH1A1
SCHEMBL31333435 0.84 MAPT (0.55) SIRT6MAPTTHRBPKMALDH1A1
SCHEMBL31333248 0.83 MAPT (0.55) SIRT6MAPTTHRBPKMALDH1A1
SCHEMBL14892233 0.81 LMNA (0.53) DRD2SIRT6MAPTSUV39H2ALDH1A1
SCHEMBL31333744 0.81 SIRT6 (0.44) SIRT6MAPTTHRBPKMALDH1A1
SCHEMBL517443 0.80 ALDH1A1 (0.58) DRD2SIRT6MAPTSUV39H2ALDH1A1
SCHEMBL381140 0.79 SIRT6 (0.56) DRD2SIRT6MAPTSUV39H2ALDH1A1
SCHEMBL31334849 0.79 DRD2 (0.54) DRD2MAPTTHRBKCNA3ALDH1A1
SCHEMBL31333982 0.79 SIRT6 (0.46) DRD2SIRT6MAPTTHRBPKM
SCHEMBL14406629 0.78 MAPT (0.56) SIRT6MAPTTHRBPKMALDH1A1

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-4709720-A1 INHIBITORS AND DEGRADERS OF PIP4K PROTEIN Larkspur Biosciences, Inc. (US) 2026-03-18 EP disclosed
WO-2024233846-A1 INHIBITORS AND DEGRADERS OF PIP4K PROTEIN LARKSPUR BIOSCIENCES, INC. (US) 2024-11-14 WO disclosed