SCHEMBL8639770

SCHEMBL8639770

COC(=O)C(=NOC(C)C)c1csc(N)n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.43
MEN1 O00255 3/20 0.43
ALDH1A1 P00352 3/20 0.43
KMT2A Q03164 3/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
ITGB1 P05556 2/20 0.41
ITGA4 P13612 2/20 0.41
LMNA P02545 3/20 0.39
MAPK1 P28482 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
NR1I2 O75469 3/20 0.38
PGR P06401 1/20 0.38
PTGS2 P35354 1/20 0.38
USP2 O75604 1/20 0.37
ESR1 P03372 1/20 0.37
KDM4E B2RXH2 1/20 0.37
GAA P10253 1/20 0.36
ABCB11 O95342 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
SCHEMBL8639766 1.00 MAPT (0.43) MAPTMEN1ALDH1A1KMT2ANPC1
SCHEMBL8618499 0.86 MAPT (0.44) MAPTMEN1ALDH1A1KMT2ANPC1
SCHEMBL8618502 0.86 MAPT (0.44) MAPTMEN1ALDH1A1KMT2ANPC1
SCHEMBL10332704 0.86 MEN1 (0.44) MAPTMEN1ALDH1A1KMT2ANPC1
SCHEMBL8618505 0.86 MAPT (0.44) MAPTMEN1ALDH1A1KMT2ANPC1
SCHEMBL7076742 0.86 MAPT (0.48) MAPTMEN1ALDH1A1KMT2ANPC1
SCHEMBL7076737 0.86 MAPT (0.48) MAPTMEN1ALDH1A1KMT2ANPC1
SCHEMBL10541670 0.86 MAPT (0.56) MAPTMEN1ALDH1A1KMT2ANPC1
SCHEMBL9349738 0.86 MAPT (0.56) MAPTMEN1ALDH1A1KMT2ANPC1
SCHEMBL9349741 0.86 MAPT (0.56) MAPTMEN1ALDH1A1KMT2ANPC1

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
EP-0859002-A1 Process for producing chloroacetylaminothiazoleacetic acid derivatives TOKUYAMA CORPORATION (JP) 1998-08-19 EP disclosed