SCHEMBL9053647

SCHEMBL9053647

O=C(O)CC(OC(CC(=O)O)C(=O)O)C(=O)O.[NaH]

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.43
SLC22A6 Q4U2R8 1/20 0.41
FOLH1 Q04609 2/20 0.37
GABRR1 P24046 2/20 0.35
LMNA P02545 1/20 0.35
TSHR P16473 1/20 0.33
CPA1 P15085 2/20 0.31
ALOX15 P16050 1/20 0.31
CPB1 P15086 1/20 0.31
CPA3 P15088 1/20 0.31
CPB2 Q96IY4 1/20 0.31
MAPT P10636 1/20 0.31
POLB P06746 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
SRR Q9GZT4 1/20 0.30

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
SCHEMBL8558212 1.00 TDP1 (0.46) TDP1SMN1; SMN2SLC22A6FOLH1GABRR1
SCHEMBL30293 0.97 TDP1 (0.48) TDP1SMN1; SMN2SLC22A6FOLH1GABRR1
SCHEMBL9406869 0.94 TDP1 (0.46) TDP1SMN1; SMN2SLC22A6FOLH1GABRR1
Ammonia Solution, Strong SCHEMBL28156292 0.94 TDP1 (0.52) TDP1SMN1; SMN2SLC22A6FOLH1GABRR1
SCHEMBL9406499 0.94 TDP1 (0.46) TDP1SMN1; SMN2SLC22A6FOLH1GABRR1
Fumaric Acid SCHEMBL5586404 0.85 TSHR (0.41) TDP1SMN1; SMN2SLC22A6FOLH1GABRR1
Maleic Acid SCHEMBL5586403 0.85 TSHR (0.41) TDP1SMN1; SMN2SLC22A6FOLH1GABRR1
Malic Acid SCHEMBL9245261 0.85 SMN1; SMN2 (0.68) TDP1SMN1; SMN2SLC22A6GABRR1LMNA
SCHEMBL11395626 0.85 SMN1; SMN2 (0.42) TDP1SMN1; SMN2SLC22A6FOLH1ALOX15
Lactic Acid SCHEMBL27469471 0.85 TP53 (0.50) TDP1SMN1; SMN2SLC22A6GABRR1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0357280-B1 Soil release agents having allylderived sulfonated end caps PROCTER & GAMBLE (US) 1996-02-28 EP disclosed
EP-0320213-B1 Improved, controlled temperature process for making 2,2'-oxodisuccinates useful as laundry detergent builders PROCTER & GAMBLE (US) 1995-03-08 EP disclosed
US-5298634-A Reacting maleate or mixture with 2,2-oxodisuccinate, fumarate and malate, calcium, magnesium divalent cations and rendering reaction mixture alkaline by adding hydroxide THE PROCTER & GAMBLE COMPANY (US) 1994-03-29 US disclosed
EP-0267653-B1 DETERGENT COMPOSITION CONTAINING ETHYLENEDIAMINE-N,N' DISUCCINIC ACID THE PROCTER & GAMBLE COMPANY (US) 1992-09-02 EP disclosed
US-4968451-A LAUNDRY DETERGENTS THE PROCTER & GAMBLE COMPANY (US) 1990-11-06 US disclosed
EP-0236007-B1 PROCESS FOR THE PREPARATION OF OXODISUCCINATES USEFUL AS DETERGENT BUILDERS THE PROCTER & GAMBLE COMPANY (US) 1990-08-29 EP disclosed
EP-0357280-A2 Soil release agents having allylderived sulfonated end caps THE PROCTER & GAMBLE COMPANY (US) 1990-03-07 EP disclosed
EP-0320213-A2 Improved, controlled temperature process for making 2,2'-oxodisuccinates useful as laundry detergent builders THE PROCTER & GAMBLE COMPANY (US) 1989-06-14 EP disclosed
EP-0267653-A2 Detergent composition containing ethylenediamine-N,N' disuccinic acid THE PROCTER & GAMBLE COMPANY (US) 1988-05-18 EP disclosed
US-4704233-A BIODEGRADABLE CHELANT THE PROCTER & GAMBLE COMPANY (US) 1987-11-03 US disclosed
US-4698181-A PEROXIDE-FREE STAIN REMOVAL THE PROCTER & GAMBLE COMPANY (US) 1987-10-06 US disclosed