SCHEMBL29130863

SCHEMBL29130863

O=C(O)Cc1[c]ccc([N+](=O)[O-])c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.51
TP53 P04637 2/20 0.41
ALDH1A1 P00352 6/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MAPT P10636 1/20 0.39
TDP1 Q9NUW8 3/20 0.39
ALOX15 P16050 2/20 0.39
CYP3A4 P08684 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
CES2 O00748 1/20 0.39
CES1 P23141 1/20 0.39
TSHR P16473 4/20 0.38
LMNA P02545 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
PTGDR2 Q9Y5Y4 1/20 0.38
POLB P06746 1/20 0.37
AHR P35869 1/20 0.37
RAB9A P51151 1/20 0.37
CASP6 P55212 1/20 0.37

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
SCHEMBL7304803 0.81 TSHR (0.42) CYP1A2TP53ALDH1A1SMN1; SMN2TDP1
SCHEMBL11286333 0.80 TSHR (0.45) CYP1A2TP53ALDH1A1SMN1; SMN2TDP1
SCHEMBL7940300 0.77 TSHR (0.42) CYP1A2TP53ALDH1A1SMN1; SMN2TDP1
SCHEMBL458041 0.77 POLB (0.43) CYP1A2TP53ALDH1A1MAPTTDP1
SCHEMBL6377117 0.77 TSHR (0.49) CYP1A2ALDH1A1MAPTTDP1ALOX15
SCHEMBL5585098 0.77 LOXL2 (0.46) ALDH1A1MAPTTDP1ALOX15CYP3A4
SCHEMBL3722491 0.75 RIPK1 (0.45) CYP1A2ALDH1A1SMN1; SMN2MAPTCYP3A4
SCHEMBL231178 0.75 KDM4E (0.42) CYP1A2ALDH1A1MAPTTDP1CYP3A4
SCHEMBL27773763 0.75 TSHR (0.39) CYP1A2TP53ALDH1A1SMN1; SMN2TDP1
SCHEMBL6507123 0.75 MAPT (0.40) CYP1A2ALDH1A1MAPTTDP1ALOX15

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-117069679-A N- (substituted phenyl) thiazole phenoxyacetamide compound and preparation method and application thereof 湖南省农业生物技术研究所 2023-11-17 CN claimed
CN-117069679-A N- (substituted phenyl) thiazole phenoxyacetamide compound and preparation method and application thereof 湖南省农业生物技术研究所 2023-11-17 CN disclosed