SCHEMBL7074341

SCHEMBL7074341

CON=C(C(=O)OC(C)C)c1csc(N)n1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1I2 O75469 4/20 0.45
PGR P06401 1/20 0.45
PTGS2 P35354 1/20 0.45
ITGB1 P05556 2/20 0.43
ITGA4 P13612 2/20 0.43
ABCB11 O95342 1/20 0.43
PTGS1 P23219 1/20 0.43
PDE4D Q08499 1/20 0.43
MAPT P10636 6/20 0.43
ALDH1A1 P00352 3/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
LMNA P02545 3/20 0.41
GAA P10253 1/20 0.41
HTR2C P28335 1/20 0.39
HSD17B10 Q99714 2/20 0.38
ALB P02768 1/20 0.38
PPARG P37231 1/20 0.38

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
SCHEMBL7074339 1.00 NR1I2 (0.45) NR1I2PGRPTGS2ITGB1ITGA4
SCHEMBL7076737 0.86 MAPT (0.48) NR1I2PGRPTGS2ITGB1ITGA4
SCHEMBL6095828 0.86 MAPT (0.47) NR1I2PGRPTGS2ITGB1ITGA4
SCHEMBL7076742 0.86 MAPT (0.48) NR1I2PGRPTGS2ITGB1ITGA4
SCHEMBL6791300 0.84 ITGB1 (0.46) NR1I2PGRPTGS2ITGB1ITGA4
SCHEMBL27360895 0.83 MAPT (0.44) NR1I2PGRPTGS2ITGB1ITGA4
SCHEMBL8313617 0.83 MAPT (0.44) NR1I2PGRPTGS2ITGB1ITGA4
SCHEMBL3929244 0.81 MAPT (0.48) NR1I2PGRPTGS2ITGB1ITGA4
SCHEMBL9982497 0.81 MAPT (0.48) NR1I2PGRPTGS2ITGB1ITGA4
SCHEMBL19236061 0.81 MAPT (0.48) NR1I2PGRPTGS2ITGB1ITGA4

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 6 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
US-5789598-A SEPARATING CARBONATE BY-PRODUCT; NEUTRALIZATION TOKUYAMA CORPORATION (JP) 1998-08-04 US disclosed
EP-0781769-A1 Process for production of alkoxycarbonylaminothiazole acetic acid derivative TOKUYAMA CORPORATION (JP) 1997-07-02 EP disclosed