SCHEMBL28449481

SCHEMBL28449481

N#Cc1c(N)cccc1OC[C@H]1CCCN1C(=O)OCc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 1/20 0.43
GAA P10253 1/20 0.43
MAPT P10636 1/20 0.43
HPGD P15428 1/20 0.43
ALOX15 P16050 1/20 0.43
KMT2A Q03164 1/20 0.43
HSD17B10 Q99714 1/20 0.43
CTRB1 P17538 1/20 0.43
PREP P48147 5/20 0.43
NPSR1 Q6W5P4 1/20 0.42
HDAC1 Q13547 1/20 0.42
KLK7 P49862 1/20 0.42
KLK5 Q9Y337 1/20 0.42
KDM4E B2RXH2 1/20 0.42
LMNA P02545 1/20 0.42

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
SCHEMBL31670301 1.00 TSHR (0.46) TSHRL3MBTL1MEN1ALDH1A1GAA
SCHEMBL28449483 1.00 TSHR (0.46) TSHRL3MBTL1MEN1ALDH1A1GAA
SCHEMBL31670275 1.00 TSHR (0.46) TSHRL3MBTL1MEN1ALDH1A1GAA
SCHEMBL28451338 1.00 TSHR (0.46) TSHRL3MBTL1MEN1ALDH1A1GAA
SCHEMBL619946 0.97 TSHR (0.43) TSHRL3MBTL1MEN1ALDH1A1GAA
SCHEMBL621635 0.86 PREP (0.40) PREP
SCHEMBL28451971 0.86 PREP (0.40) PREP
SCHEMBL28461106 0.86 PREP (0.40) PREP
SCHEMBL621414 0.83 ALDH1A1 (0.46) TSHRL3MBTL1MEN1ALDH1A1GAA
SCHEMBL620334 0.83 HDAC1 (0.40) PREPHDAC1

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
CN-106107406-B Methods of improving the stability of sweetness enhancers and compositions comprising stable sweetness enhancers 弗门尼舍公司 2020-06-09 CN disclosed