SCHEMBL7071663

SCHEMBL7071663

CO/N=C(\C(=O)OCc1ccccc1)c1csc(N)n1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ITGB1 P05556 2/20 0.46
ITGA4 P13612 2/20 0.46
MAPT P10636 6/20 0.46
KMT2A Q03164 5/20 0.46
MEN1 O00255 4/20 0.46
ALDH1A1 P00352 2/20 0.46
LMNA P02545 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
MAPK1 P28482 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
NR1I2 O75469 3/20 0.42
ALB P02768 1/20 0.42
PPARG P37231 1/20 0.42
SLC22A6 Q4U2R8 1/20 0.42
SLC22A8 Q8TCC7 1/20 0.42
SLC22A11 Q9NSA0 1/20 0.42
HTR2C P28335 1/20 0.42
PGR P06401 1/20 0.41

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
SCHEMBL7071564 1.00 ITGB1 (0.46) ITGB1ITGA4MAPTKMT2AMEN1
SCHEMBL10947389 0.84 MEN1 (0.56) ITGB1ITGA4MAPTKMT2AMEN1
SCHEMBL8640977 0.84 MEN1 (0.56) ITGB1ITGA4MAPTKMT2AMEN1
SCHEMBL8625298 0.84 MEN1 (0.56) ITGB1ITGA4MAPTKMT2AMEN1
SCHEMBL10545685 0.84 MEN1 (0.46) ITGB1ITGA4MAPTKMT2AMEN1
SCHEMBL10545680 0.84 MEN1 (0.46) ITGB1ITGA4MAPTKMT2AMEN1
SCHEMBL1143128 0.83 MAPT (0.59) ITGB1ITGA4MAPTKMT2AMEN1
SCHEMBL1143127 0.83 MAPT (0.59) ITGB1ITGA4MAPTKMT2AMEN1
SCHEMBL9076641 0.83 MAPT (0.59) ITGB1ITGA4MAPTKMT2AMEN1
Bromide SCHEMBL9659504 0.82 MAPT (0.58) ITGB1ITGA4MAPTKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0859002-B1 Process for producing chloroacetylaminothiazoleacetic acid derivatives TOKUYAMA CORP (JP) 2003-07-02 EP disclosed
CN-1071326-C Process for producing chloroacetylaminothiazoleacetic acid derivatives TOKUYAMA CORP (JP) 2001-09-19 CN disclosed
CN-1211571-A Process for producing chloroacetylaminothiazoleacetic acid derivatives TOKUYAMA CORP (JP) 1999-03-24 CN disclosed
EP-0859002-A1 Process for producing chloroacetylaminothiazoleacetic acid derivatives TOKUYAMA CORPORATION (JP) 1998-08-19 EP disclosed