SCHEMBL27318752

SCHEMBL27318752

CCOC(=O)c1c(Cl)cnc(C)c1[N+](=O)[O-]

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.42
ALDH1A1 P00352 4/20 0.42
NPC1 O15118 4/20 0.42
NPSR1 Q6W5P4 2/20 0.42
HTT P42858 2/20 0.42
TP53 P04637 1/20 0.42
XBP1 P17861 1/20 0.42
MAPK1 P28482 1/20 0.42
HSD17B10 Q99714 1/20 0.42
TLR9 Q9NR96 1/20 0.42
POLB P06746 2/20 0.41
PDE4B Q07343 2/20 0.40
PDE4D Q08499 2/20 0.40
PRKCZ Q05513 1/20 0.40
KDM4E B2RXH2 3/20 0.40
RAB9A P51151 2/20 0.40
AR P10275 2/20 0.40
LMNA P02545 2/20 0.40
GAA P10253 1/20 0.40
HPGD P15428 1/20 0.40

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
SCHEMBL9753804 0.83 ALDH1A1 (0.42) MAPTALDH1A1NPC1MAPK1POLB
SCHEMBL9270724 0.77 POLB (0.47) MAPTALDH1A1NPC1NPSR1MAPK1
SCHEMBL30593158 0.76 POLB (0.42) MAPTALDH1A1NPC1NPSR1HTT
SCHEMBL11628165 0.76 POLB (0.42) MAPTALDH1A1NPC1NPSR1HTT
SCHEMBL30101777 0.76 ALDH1A1 (0.44) MAPTALDH1A1NPC1NPSR1XBP1
SCHEMBL11728849 0.74 KDM4E (0.46) MAPTALDH1A1NPC1NPSR1TP53
SCHEMBL22445772 0.73 ALDH1A1 (0.48) MAPTALDH1A1NPC1NPSR1HTT
SCHEMBL574989 0.72 ALDH1A1 (0.49) MAPTALDH1A1NPC1NPSR1XBP1
SCHEMBL30846439 0.72 ALDH1A1 (0.49) MAPTALDH1A1NPC1NPSR1XBP1
SCHEMBL27314724 0.72 ALDH1A1 (0.49) MAPTALDH1A1NPC1NPSR1HTT

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
CN-1031053-C Azaoxindole derivatives PFIZER (US) 1996-02-21 CN disclosed
CN-1053065-A AZAOXINDOLE DERIVATIVES PFIZER (US) 1991-07-17 CN disclosed