SCHEMBL8565353

SCHEMBL8565353

O=C(O)[C@H](CS(=O)(=O)O)N1C(=O)CC(O)C1=O

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MME P08473 1/20 0.47
CYP1A2 P05177 1/20 0.32
CYP2C19 P33261 1/20 0.32
ALDH1A1 P00352 1/20 0.32
PKM P14618 1/20 0.32
PPM1B O75688 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL9853724 0.80 MME (0.47) MMECYP1A2CYP2C19ALDH1A1PKM
SCHEMBL16339806 0.80 MME (0.47) MMECYP1A2CYP2C19ALDH1A1PKM
SCHEMBL4594736 0.74 MAPK1 (0.46) MMECYP1A2CYP2C19ALDH1A1PPM1B
SCHEMBL8818604 0.72 CYP2C19 (0.44) MMECYP1A2CYP2C19ALDH1A1PPM1B
SCHEMBL9291274 0.72 MME (0.44) MMECYP1A2CYP2C19
SCHEMBL859388 0.69 MME (0.46) MMECYP1A2CYP2C19ALDH1A1PKM
SCHEMBL8818955 0.65 MME (0.42) MMECYP1A2CYP2C19ALDH1A1PPM1B
SCHEMBL5142303 0.63 MME (0.40) MMECYP1A2CYP2C19ALDH1A1PPM1B
SCHEMBL2239737 0.62 POLB (0.51) MMEALDH1A1PKM
SCHEMBL10425267 0.62 POLB (0.44) ALDH1A1PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-5693854-A CHELANTS; BUILDERS FOR DETERGENTS LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. 1997-12-02 US disclosed
US-5688996-A DETERGENTS OR BUILDERS LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. (US) 1997-11-18 US disclosed
US-5686402-A ANTISOILANTS; REDUCED PHOSPHATE CONTENT LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. (US) 1997-11-11 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
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-5663427-A BUILDERS FOR LAUNDRY DETERGENTS LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. (US) 1997-09-02 US disclosed
WO-1997023450-A1 CYSTEIC MONOSUCCINATE SEQUESTRANTS AND DETERGENT COMPOSITIONS CONTAINING THEM UNILEVER PLC (GB) 1997-07-03 WO disclosed