SCHEMBL8768872

SCHEMBL8768872

NCCC[C@H](NCO)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 1/20 0.47
GGT1 P19440 1/20 0.46
CPB2 Q96IY4 5/20 0.44
GSR P00390 1/20 0.42
RNPEP Q9H4A4 1/20 0.41
SLC6A5 Q9Y345 1/20 0.40
MMP2 P08253 1/20 0.39
MMP9 P14780 1/20 0.39
GNPAT O15228 1/20 0.36
GABRR1 P24046 3/20 0.35
TGFBR1 P36897 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
GABRR3 A8MPY1 1/20 0.34
GABRP O00591 1/20 0.34
GABRD O14764 1/20 0.34
HDAC3 O15379 1/20 0.34
GABBR2 O75899 1/20 0.34
LMNA P02545 1/20 0.34
CYP1A2 P05177 1/20 0.34

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
SCHEMBL7198357 1.00 FOLH1 (0.47) FOLH1GGT1CPB2GSRRNPEP
Hydrochloric Acid SCHEMBL10780765 0.98 FOLH1 (0.46) FOLH1GGT1CPB2GSRRNPEP
SCHEMBL7198299 0.94 FOLH1 (0.54) FOLH1GGT1CPB2GSRRNPEP
SCHEMBL7225798 0.94 FOLH1 (0.54) FOLH1GGT1CPB2GSRRNPEP
SCHEMBL11155336 0.86 FOLH1 (0.50) FOLH1GGT1CPB2GSRRNPEP
SCHEMBL11148798 0.86 FOLH1 (0.50) FOLH1GGT1CPB2GSRRNPEP
SCHEMBL28165413 0.86 FOLH1 (0.50) FOLH1GGT1CPB2GSRRNPEP
SCHEMBL31384587 0.84 GGT1 (0.51) FOLH1GGT1CPB2GSRRNPEP
SCHEMBL31384586 0.84 GGT1 (0.51) FOLH1GGT1CPB2GSRRNPEP
SCHEMBL6010381 0.83 FOLH1 (0.41) FOLH1GGT1CPB2GSRRNPEP

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-0792146-A1 INACTIVATION OF PATHOGENS USING HYDROXYMETHYLAMINES HEMASURE, INC. (US) 1997-09-03 EP claimed
WO-1997002028-A1 INACTIVATION OF PATHOGENS USING HYDROXYMETHYLAMINES HEMASURE, INC. (US) 1997-01-23 WO claimed
EP-0792146-A1 INACTIVATION OF PATHOGENS USING HYDROXYMETHYLAMINES HEMASURE, INC. (US) 1997-09-03 EP disclosed
WO-1997002028-A1 INACTIVATION OF PATHOGENS USING HYDROXYMETHYLAMINES HEMASURE, INC. (US) 1997-01-23 WO disclosed