SCHEMBL30701677

SCHEMBL30701677

CCOC(=O)c1c(N(Cc2ccccc2Cl)C(C)=O)sc2c(Cl)c(O)ccc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 9/20 0.43
▸ PTGES O14684 3/20 0.43
▸ MAPT P10636 5/20 0.39
▸ LMNA P02545 2/20 0.39
▸ ALOX12 P18054 1/20 0.39
▸ SLC2A1 P11166 1/20 0.39
▸ GAA P10253 2/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ GRM6 O15303 2/20 0.38
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ ALOX15 P16050 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ CA12 O43570 1/20 0.36
▸ CA1 P00915 1/20 0.36
▸ CA2 P00918 1/20 0.36
▸ CA7 P43166 1/20 0.36
▸ CA9 Q16790 1/20 0.36
▸ CA14 Q9ULX7 1/20 0.36

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
SCHEMBL24683856 1.00 ALOX5 (0.43) ALOX5PTGESMAPTLMNAALOX12
SCHEMBL24683205 0.90 LMNA (0.38) ALOX5MAPTLMNAMEN1KMT2A
SCHEMBL29799927 0.90 LMNA (0.38) ALOX5MAPTLMNAMEN1KMT2A
SCHEMBL30701705 0.89 MCL1 (0.39) GAAMEN1KMT2A
SCHEMBL24683876 0.89 MCL1 (0.39) GAAMEN1KMT2A
SCHEMBL24683204 0.88 KMT2A (0.45) ALOX5PTGESMAPTLMNAALOX12
SCHEMBL29799918 0.88 KMT2A (0.45) ALOX5PTGESMAPTLMNAALOX12
SCHEMBL30701659 0.84 KMT2A (0.34) ALOX5PTGESMAPTLMNAALDH1A1
SCHEMBL24682972 0.84 KMT2A (0.34) ALOX5PTGESMAPTLMNAALDH1A1
SCHEMBL24682183 0.84 MAPT (0.39) ALOX5PTGESMAPTLMNAALOX12

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-117222630-A 2-acetamido-6-hydroxy-benzothiophene derivatives having antiviral activity OTC制药公司(JSC) 2023-12-12 — — CN disclosed
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