SCHEMBL8428903

SCHEMBL8428903

CCc1c([Se]c2cccc(C)c2)n(COCc2ccccc2)c(=S)[nH]c1=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.44
SIRT2 Q8IXJ6 1/20 0.36
SIRT1 Q96EB6 1/20 0.36
GAA P10253 2/20 0.35
KDM4E B2RXH2 2/20 0.34
HPGD P15428 2/20 0.33
ALOX12 P18054 2/20 0.33
MAPT P10636 2/20 0.33
TK1 P04183 1/20 0.33
PKM P14618 1/20 0.33
KMT2A Q03164 3/20 0.32
MEN1 O00255 2/20 0.32
POLB P06746 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
LMNA P02545 1/20 0.32
NR3C1 P04150 1/20 0.32
L3MBTL1 Q9Y468 2/20 0.31
RAB9A P51151 2/20 0.31
STAT1 P42224 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
SCHEMBL7534059 0.92 ALDH1A1 (0.46) ALDH1A1SIRT2SIRT1GAAKDM4E
SCHEMBL8430407 0.91 ALDH1A1 (0.52) ALDH1A1KDM4EHPGDMAPTTK1
SCHEMBL9016377 0.91 ALDH1A1 (0.47) ALDH1A1SIRT2SIRT1GAAKDM4E
SCHEMBL8430921 0.89 ALDH1A1 (0.34) ALDH1A1SIRT2SIRT1GAAKDM4E
SCHEMBL8426834 0.86 ALDH1A1 (0.43) ALDH1A1GAAKDM4EHPGDALOX12
SCHEMBL8430467 0.85 ALDH1A1 (0.34) ALDH1A1GAAKDM4EHPGDALOX12
SCHEMBL7535269 0.83 ALDH1A1 (0.54) ALDH1A1KDM4EHPGDMAPTTK1
SCHEMBL9016369 0.81 ALDH1A1 (0.56) ALDH1A1KDM4EHPGDMAPTTK1
SCHEMBL8426995 0.81 SIRT2 (0.40) ALDH1A1SIRT2SIRT1GAAKDM4E
SCHEMBL8426962 0.81 ALDH1A1 (0.37) ALDH1A1HPGDMAPTKMT2AMEN1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5889013-A REACTING AN URACIL COMPOUND WITH N, O-BIS/TRIMETHYLSILYL/ACETAMIDE FOLLOWED BY TETRABUTYLAMMONIUM IODIDE AND CHLOROMETHYL ETHER COMPOUND AND THEN REACTING WITH ARYL SELENOL IN A BASE SUNKYONG INDUSTRIES CO., INC. (KR) 1999-03-30 US disclosed
EP-0748316-A1 PYRIMIDINE ACYCLONUCLEOSIDE DERIVATIVES SUNKYONG INDUSTRIES CO., LTD. (KR) 1996-12-18 EP disclosed
WO-1995023138-A1 PYRIMIDINE ACYCLONUCLEOSIDE DERIVATIVES SUNKYONG INDUSTRIES CO., LTD. (KR) 1995-08-31 WO disclosed