SCHEMBL31334467

SCHEMBL31334467

CC(C)(C)OC(=O)C1CCN(CCC2CCN(c3ccc([N+](=O)[O-])c(O)c3)CC2)CC1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SIRT6 Q8N6T7 2/20 0.50
MAPT P10636 15/20 0.49
ALDH1A1 P00352 4/20 0.49
THRB P10828 1/20 0.45
PKM P14618 1/20 0.45
TP53 P04637 1/20 0.40
HTT P42858 1/20 0.40
DRD2 P14416 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
GALR3 O60755 1/20 0.39
RAB9A P51151 1/20 0.39
CYP1A2 P05177 1/20 0.38
CYP2C19 P33261 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
SCHEMBL31333610 0.85 SIRT6 (0.51) SIRT6MAPTALDH1A1THRBPKM
SCHEMBL26495684 0.81 ALDH1A1 (0.52) SIRT6MAPTALDH1A1TP53HTT
SCHEMBL30497535 0.81 ALDH1A1 (0.52) SIRT6MAPTALDH1A1TP53HTT
SCHEMBL31334881 0.80 SIRT6 (0.48) SIRT6MAPTALDH1A1THRBPKM
SCHEMBL31333435 0.79 MAPT (0.55) SIRT6MAPTALDH1A1THRBPKM
SCHEMBL31333447 0.78 DRD2 (0.47) SIRT6MAPTALDH1A1THRBPKM
SCHEMBL31333430 0.78 MAPT (0.51) MAPTALDH1A1THRBHTTDRD2
SCHEMBL4516920 0.78 MAPT (0.56) SIRT6MAPTALDH1A1DRD2GALR3
SCHEMBL30919620 0.77 MAPT (0.63) MAPTALDH1A1HTTTDP1GALR3
SCHEMBL30258576 0.77 MAPT (0.60) MAPTALDH1A1HTTTDP1CYP1A2

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