SCHEMBL9533577

SCHEMBL9533577

CCOC(=O)C(CC(=O)O)S(=O)(=O)O.[NaH].[NaH].[NaH]

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.41
PIN1 Q13526 1/20 0.37
MEN1 O00255 1/20 0.36
NPC1 O15118 1/20 0.36
KMT2A Q03164 1/20 0.36
ALDH1A1 P00352 6/20 0.36
LMNA P02545 1/20 0.34
HSD17B10 Q99714 1/20 0.34
CYP2D6 P10635 2/20 0.33
ALOX15 P16050 1/20 0.33
MGAM O43451 1/20 0.33
GAA P10253 1/20 0.33
SI P14410 1/20 0.33
MGAM2 Q2M2H8 1/20 0.33
EGLN1 Q9GZT9 1/20 0.33
SOAT1 P35610 1/20 0.33
HCAR2 Q8TDS4 1/20 0.32
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32

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
SCHEMBL11517716 1.00 RECQL (0.41) RECQLPIN1MEN1NPC1KMT2A
SCHEMBL27455944 1.00 RECQL (0.41) RECQLPIN1MEN1NPC1KMT2A
SCHEMBL6565411 0.98 RECQL (0.41) RECQLPIN1MEN1NPC1KMT2A
Ammonia Solution, Strong SCHEMBL29249910 0.96 RECQL (0.41) RECQLPIN1MEN1NPC1KMT2A
SCHEMBL29249948 0.96 RECQL (0.41) RECQLPIN1MEN1NPC1KMT2A
Ammonia Solution, Strong SCHEMBL27898779 0.96 RECQL (0.41) RECQLPIN1MEN1NPC1KMT2A
SCHEMBL29249898 0.96 RECQL (0.41) RECQLPIN1MEN1NPC1KMT2A
SCHEMBL17925316 0.86 RECQL (0.44) RECQLPIN1MEN1NPC1KMT2A
SCHEMBL662228 0.84 RECQL (0.51) RECQLPIN1KMT2AALDH1A1LMNA
SCHEMBL27329281 0.84 RECQL (0.51) RECQLPIN1KMT2AALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0550652-A1 DETERGENT COMPOSITIONS CONTAINING ALKYL ETHOXY CARBOZYLATES AND POLYHYDROXY FATTY ACID AMIDES. PROCTER & GAMBLE (US) 1993-07-14 EP disclosed
WO-1992006157-A1 DETERGENT COMPOSITIONS CONTAINING ALKYL ETHOXY CARBOZYLATES AND POLYHYDROXY FATTY ACID AMIDES THE PROCTER & GAMBLE COMPANY (US) 1992-04-16 WO disclosed