SCHEMBL7298229

SCHEMBL7298229

O=C(O)COCC1CCCN1C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
FFAR1 O14842 7/20 0.38
CYP2D6 P10635 1/20 0.34
DPP4 P27487 1/20 0.34
DPP8 Q6V1X1 1/20 0.34
DPP9 Q86TI2 1/20 0.34
DPP7 Q9UHL4 1/20 0.34
PTGIR P43119 2/20 0.33
CHRNB2 P17787 1/20 0.33
CHRNA5 P30532 1/20 0.33
CHRNA7 P36544 1/20 0.33
CHRNA4 P43681 1/20 0.33
LTA4H P09960 1/20 0.33
ABHD6 Q9BV23 1/20 0.33
DAGLA Q9Y4D2 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33
REN P00797 1/20 0.33
ACE P12821 1/20 0.33
MVD P53602 2/20 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
SCHEMBL7059997 1.00 POLB (0.42) POLBL3MBTL1FFAR1CYP2D6DPP4
SCHEMBL7066111 0.95 ABHD6 (0.37) POLBL3MBTL1FFAR1PTGIRLTA4H
SCHEMBL3828293 0.84 POLB (0.38) POLBL3MBTL1FFAR1CYP2D6DPP4
SCHEMBL8525958 0.82 KMT2A (0.40) POLBL3MBTL1CYP2D6CHRNB2CHRNA5
SCHEMBL6319985 0.81 HSD17B10 (0.46)
SCHEMBL2568345 0.81 HSD17B10 (0.46)
SCHEMBL3774461 0.81 HSD17B10 (0.46)
SCHEMBL2566481 0.81 HSD17B10 (0.38) POLBL3MBTL1DPP4DPP8
SCHEMBL3832136 0.81 HSD17B10 (0.38) POLBL3MBTL1DPP4DPP8
SCHEMBL15608178 0.80 POLB (0.46) POLBL3MBTL1FFAR1DPP4DPP7

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
EP-0928793-B1 Thiazole derivatives HOFFMANN LA ROCHE (CH) 2002-05-15 EP disclosed
US-6001855-A REACTING A THIAZOLE DERIVATIVE AND A CYCLIC AMINE DERIVATIVE; INHIBITS BINDING OF ADHESIVE PROTEINS TO THE SURFACE OF DIFFERENT TYPES OF CELL AND ACCORDINGLY INFLUENCE CELL-CELL AND CELL-MATRIX INTERACTIONS HOFFMAN-LA ROCHE INC. (US) 1999-12-14 US disclosed
EP-0928793-A1 Thiazole derivatives F. HOFFMANN-LA ROCHE AG (CH) 1999-07-14 EP disclosed