SCHEMBL31334246

SCHEMBL31334246

CCOC(=O)CC1CCN(c2ccc([N+](=O)[O-])cc2F)CC1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.61
ALDH1A1 P00352 7/20 0.61
LMNA P02545 3/20 0.61
THRB P10828 1/20 0.53
KMT2A Q03164 2/20 0.51
TDP1 Q9NUW8 1/20 0.50
HTT P42858 1/20 0.49
GPR174 Q9BXC1 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
POLB P06746 2/20 0.47
MEN1 O00255 1/20 0.47
MAPK1 P28482 1/20 0.47
DGAT1 O75907 1/20 0.47

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
SCHEMBL25446993 0.87 ALDH1A1 (0.51) MAPTALDH1A1LMNATHRBKMT2A
SCHEMBL29772057 0.87 MAPT (0.56) MAPTALDH1A1LMNATHRBKMT2A
SCHEMBL25169812 0.86 MAPT (0.48) MAPTALDH1A1LMNATDP1GPR174
SCHEMBL29772052 0.85 MAPT (0.55) MAPTALDH1A1LMNATHRBKMT2A
SCHEMBL29772039 0.85 ALDH1A1 (0.54) MAPTALDH1A1LMNATHRBKMT2A
SCHEMBL29772149 0.83 ALDH1A1 (0.52) MAPTALDH1A1LMNATHRBKMT2A
SCHEMBL29772143 0.83 ALDH1A1 (0.52) MAPTALDH1A1LMNATHRBKMT2A
SCHEMBL31334575 0.83 ALDH1A1 (0.47) MAPTALDH1A1LMNATHRBKMT2A
SCHEMBL10036407 0.83 ALDH1A1 (0.63) MAPTALDH1A1LMNATHRBKMT2A
SCHEMBL24124687 0.82 ALDH1A1 (0.53) MAPTALDH1A1LMNATHRBKMT2A

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