SCHEMBL28295721

SCHEMBL28295721

CS(=O)(=O)n1cccc1NC=O

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
HTR6 P50406 1/20 0.33
PPME1 Q9Y570 3/20 0.33
APEH P13798 1/20 0.33
LMNA P02545 1/20 0.33
TRIM24 O15164 1/20 0.31
TRIM33 Q9UPN9 1/20 0.31

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
SCHEMBL28194790 0.72
SCHEMBL2460281 0.71 TRIM24 (0.52) ALDH1A1HTR6PPME1APEHTRIM24
SCHEMBL29512049 0.70 HTR6 (0.38) HTR6PPME1APEH
SCHEMBL28266002 0.68
SCHEMBL28028310 0.68
SCHEMBL15155241 0.67 HTR6 (0.39) ALDH1A1HTR6PPME1APEH
SCHEMBL5776603 0.66 HTR6 (0.38) HTR6PPME1APEH
SCHEMBL16530109 0.65 HTR6 (0.39) ALDH1A1HTR6PPME1APEHLMNA
SCHEMBL27985186 0.65 ALDH1A1 (0.35) ALDH1A1
Pyridine SCHEMBL28875144 0.63 TRIM24 (0.39) ALDH1A1LMNATRIM24TRIM33

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-106414448-B It can be used as the new compound of S100- inhibitor 活跃生物技术有限公司 2019-04-19 CN disclosed