SCHEMBL27857421

SCHEMBL27857421

CC(C)C(=O)OS(=O)(=O)c1cc(Br)ccc1Br

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.50
KMT2A Q03164 4/20 0.44
MEN1 O00255 3/20 0.44
NPSR1 Q6W5P4 1/20 0.42
LMNA P02545 3/20 0.38
SMN1; SMN2 Q16637 3/20 0.36
GLA P06280 1/20 0.36
MAPT P10636 1/20 0.35
HTT P42858 1/20 0.35
BLM P54132 1/20 0.35
EDNRB P24530 2/20 0.35
EDNRA P25101 2/20 0.35
POLB P06746 3/20 0.35
TSHR P16473 2/20 0.34
CTSL P07711 1/20 0.34
CTSS P25774 1/20 0.34
CTSK P43235 1/20 0.34
CTSC P53634 1/20 0.34
KDM4E B2RXH2 1/20 0.33
TP53 P04637 1/20 0.33

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
SCHEMBL196869 0.77 ALDH1A1 (0.44) ALDH1A1KMT2AMEN1NPSR1LMNA
SCHEMBL27857417 0.73 ELANE (0.33) ELANE
SCHEMBL197324 0.73 ALDH1A1 (0.45) ALDH1A1KMT2AMEN1NPSR1LMNA
SCHEMBL198462 0.71 NPSR1 (0.43) ALDH1A1KMT2AMEN1NPSR1LMNA
SCHEMBL13268376 0.70 ELANE (0.40) ALDH1A1KMT2AMEN1LMNASMN1; SMN2
SCHEMBL27857425 0.69 ELANE (0.33) ELANE
SCHEMBL198694 0.68 ALDH1A1 (0.44) ALDH1A1KMT2AMEN1LMNAEDNRB
SCHEMBL4157506 0.68 LMNA (0.47) ALDH1A1KMT2AMEN1LMNASMN1; SMN2
SCHEMBL31357032 0.68 ALDH1A1 (0.44) ALDH1A1KMT2AMEN1LMNAEDNRB
SCHEMBL198961 0.68 ALDH1A1 (0.46) ALDH1A1KMT2AMEN1NPSR1LMNA

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-101341183-B Polyarylene and process for producing the same SUMITOMO CO LTD 2012-06-20 CN disclosed