SCHEMBL8562008

SCHEMBL8562008

O=C(O)C[C@@H](C(=O)O)N1CC1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.43
TDP1 Q9NUW8 1/20 0.42
POLB P06746 2/20 0.40
MAPK1 P28482 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
ALDH1A1 P00352 1/20 0.39
TP53 P04637 1/20 0.39
MAPT P10636 2/20 0.39
LMNA P02545 1/20 0.38
SLC22A6 Q4U2R8 1/20 0.38
NPSR1 Q6W5P4 1/20 0.37

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
SCHEMBL17706711 1.00 HSD17B10 (0.43) HSD17B10TDP1POLBMAPK1SMN1; SMN2
SCHEMBL11713448 1.00 HSD17B10 (0.43) HSD17B10TDP1POLBMAPK1SMN1; SMN2
SCHEMBL31532972 0.91 L3MBTL1 (0.41) HSD17B10TDP1POLBMAPK1SMN1; SMN2
SCHEMBL16415859 0.89 MAPT (0.50) HSD17B10TDP1POLBMAPK1L3MBTL1
SCHEMBL28295367 0.89 DPP7 (0.46) HSD17B10TDP1POLBMAPK1SMN1; SMN2
SCHEMBL8625882 0.89 DPP7 (0.46) HSD17B10TDP1POLBMAPK1SMN1; SMN2
Aspartic Acid SCHEMBL1959842 0.88 DPP7 (0.46) HSD17B10
Aspartic Acid SCHEMBL150400 0.88 DPP7 (0.46) HSD17B10
SCHEMBL4372205 0.88 HSD17B10 (0.37) HSD17B10TDP1POLBMAPK1L3MBTL1
SCHEMBL15780321 0.88 SLC6A9 (0.45) HSD17B10TDP1POLBMAPK1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0796842-A3 Ethylene aspartate cysteate sequestrants, methods of producing them and detergent compositions containing them UNILEVER PLC (GB) 1998-05-06 EP disclosed
US-5739093-A DETERGENT CONTAINING ETHYLENE APARTIC GLUTAMIC ACID OR SALT THEREOF; IMPROVED STAIN REMOVAL LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. (US) 1998-04-14 US disclosed
US-5739093-A DETERGENT CONTAINING ETHYLENE APARTIC GLUTAMIC ACID OR SALT THEREOF; IMPROVED STAIN REMOVAL LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. (US) 1998-04-14 US disclosed
US-5739093-A DETERGENT CONTAINING ETHYLENE APARTIC GLUTAMIC ACID OR SALT THEREOF; IMPROVED STAIN REMOVAL LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. (US) 1998-04-14 US disclosed
US-5688996-A DETERGENTS OR BUILDERS LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. (US) 1997-11-18 US disclosed
EP-0796842-A2 Ethylene aspartate cysteate sequestrants, methods of producing them and detergent compositions containing them UNILEVER PLC (GB) 1997-09-24 EP disclosed
EP-0796842-A2 Ethylene aspartate cysteate sequestrants, methods of producing them and detergent compositions containing them UNILEVER PLC (GB) 1997-09-24 EP disclosed
US-5668098-A Detergent compositions containing ethylene aspartate cysteate (EAC) sequestrants LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. (US) 1997-09-16 US disclosed
US-5668098-A Detergent compositions containing ethylene aspartate cysteate (EAC) sequestrants LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. (US) 1997-09-16 US disclosed
US-5668098-A Detergent compositions containing ethylene aspartate cysteate (EAC) sequestrants LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. (US) 1997-09-16 US disclosed