SCHEMBL31558260

SCHEMBL31558260

CCOC(=O)c1cc(C)nc(Cl)c1[N+](=O)[O-]

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.44
POLB P06746 3/20 0.44
LMNA P02545 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
NPSR1 Q6W5P4 2/20 0.44
GALR2 O43603 1/20 0.44
MITF O75030 1/20 0.44
HSP90AA1 P07900 1/20 0.44
HPGD P15428 1/20 0.44
XBP1 P17861 1/20 0.44
CCR6 P51684 1/20 0.44
KDM4E B2RXH2 3/20 0.43
MAPT P10636 5/20 0.42
KMT2A Q03164 4/20 0.42
MEN1 O00255 3/20 0.41
HTT P42858 2/20 0.41
AGTR1 P30556 1/20 0.41
NPC1 O15118 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
IKBKB O14920 1/20 0.41

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
SCHEMBL21195964 0.86 ALDH1A1 (0.43) ALDH1A1POLBSMN1; SMN2HPGDKDM4E
SCHEMBL7015986 0.82 MAPT (0.45) ALDH1A1POLBLMNASMN1; SMN2NPSR1
SCHEMBL27344305 0.81 ALDH1A1 (0.44) ALDH1A1POLBLMNASMN1; SMN2NPSR1
SCHEMBL29105406 0.78 NUDT1 (0.46) ALDH1A1POLBLMNASMN1; SMN2NPSR1
SCHEMBL10181187 0.77 ALDH1A1 (0.51) ALDH1A1POLBLMNASMN1; SMN2NPSR1
SCHEMBL22902580 0.77 IKBKB (0.53) ALDH1A1SMN1; SMN2HSP90AA1HPGDKDM4E
SCHEMBL28813636 0.76 ALDH1A1 (0.54) ALDH1A1POLBLMNASMN1; SMN2NPSR1
SCHEMBL8322183 0.75 ALDH1A1 (0.53) ALDH1A1POLBLMNASMN1; SMN2NPSR1
SCHEMBL30846439 0.75 ALDH1A1 (0.49) ALDH1A1POLBLMNASMN1; SMN2NPSR1
SCHEMBL574989 0.75 ALDH1A1 (0.49) ALDH1A1POLBLMNASMN1; SMN2NPSR1

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-2025101598-A1 BI-CYCLIC PYRIMIDINE COMPOUNDS, METHODS AND USES THEREOF ZENO MANAGEMENT, INC. (US) 2025-05-15 WO disclosed