SCHEMBL30985145

SCHEMBL30985145

CC(C)(C)OC(=O)N1CCC2(CCC(N3CCN(c4ccc([N+](=O)[O-])cc4)CC3)CC2)CC1

nearest known ligand 0.69

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.69
ALDH1A1 P00352 2/20 0.69
LMNA P02545 2/20 0.69
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
SMN1; SMN2 Q16637 1/20 0.50
GPR119 Q8TDV5 9/20 0.47
CYP1A2 P05177 1/20 0.44
CYP2D6 P10635 1/20 0.44

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
SCHEMBL30985121 0.94 MAPT (0.67) MAPTALDH1A1LMNAMEN1KMT2A
SCHEMBL30984714 0.94 MAPT (0.64) MAPTALDH1A1LMNAMEN1KMT2A
SCHEMBL30985146 0.93 MAPT (0.67) MAPTALDH1A1LMNAMEN1KMT2A
SCHEMBL30984884 0.91 MAPT (0.71) MAPTALDH1A1LMNAMEN1KMT2A
SCHEMBL8352689 0.90 MAPT (0.78) MAPTALDH1A1LMNAMEN1KMT2A
SCHEMBL10035910 0.89 MAPT (0.80) MAPTALDH1A1LMNAMEN1KMT2A
SCHEMBL30722421 0.88 MAPT (0.78) MAPTALDH1A1LMNAMEN1KMT2A
SCHEMBL30985129 0.87 MAPT (0.62) MAPTALDH1A1LMNAMEN1KMT2A
SCHEMBL30985212 0.87 MAPT (0.67) MAPTALDH1A1LMNASMN1; SMN2GPR119
SCHEMBL30985158 0.83 MAPT (0.65) MAPTALDH1A1LMNASMN1; SMN2GPR119

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-2024146502-A1 WEE1 DEGRADING COMPOUNDS BEIJING NEOX BIOTECH LIMITED (CN) 2024-07-11 WO disclosed