SCHEMBL1388075

SCHEMBL1388075

CS(=O)(=O)C1CCCN1C(=O)OCc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PREP P48147 3/20 0.55
ACE2 Q9BYF1 3/20 0.54
NPSR1 Q6W5P4 1/20 0.52
TSHR P16473 2/20 0.51
RAB9A P51151 2/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
KLK7 P49862 1/20 0.51
KLK5 Q9Y337 1/20 0.51
KDM4E B2RXH2 1/20 0.51
LMNA P02545 1/20 0.51
CYP3A4 P08684 1/20 0.51
MAPT P10636 1/20 0.51
CYP2C9 P11712 1/20 0.51
GFER P55789 1/20 0.50
NPC1 O15118 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50

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
SCHEMBL31388203 0.88 PREP (0.55) PREPACE2NPSR1TSHRRAB9A
SCHEMBL30845587 0.82 PREP (0.53) PREPACE2NPSR1TSHRRAB9A
SCHEMBL5786248 0.82 PREP (0.53) PREPACE2NPSR1TSHRRAB9A
SCHEMBL1873676 0.82 PREP (0.53) PREPACE2NPSR1TSHRRAB9A
SCHEMBL1873488 0.81 PREP (0.52) PREPACE2NPSR1TSHRRAB9A
SCHEMBL6597133 0.81 PREP (0.52) PREPACE2NPSR1TSHRRAB9A
SCHEMBL7939228 0.81 PREP (0.52) PREPACE2NPSR1TSHRRAB9A
SCHEMBL15372095 0.81 PREP (0.59) PREPACE2NPSR1TSHRRAB9A
SCHEMBL1355639 0.81 PREP (0.59) PREPACE2NPSR1TSHRRAB9A
SCHEMBL1355641 0.81 PREP (0.59) PREPACE2NPSR1TSHRRAB9A

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
JP-H09502979-A 1997-03-25 JP claimed