SCHEMBL7208467

SCHEMBL7208467

O=C(O)CCC(OC(=O)O)(C(=O)O)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.39
ALDH1A1 P00352 2/20 0.39
MEN1 O00255 1/20 0.39
CYP1A2 P05177 1/20 0.39
THRB P10828 1/20 0.39
NAALAD2 Q9Y3Q0 1/20 0.38
LMNA P02545 4/20 0.36
ALKBH5 Q6P6C2 1/20 0.36
SUCNR1 Q9BXA5 1/20 0.36
EGLN1 Q9GZT9 1/20 0.36
TSHR P16473 2/20 0.36
HSD17B10 Q99714 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
SLC22A6 Q4U2R8 1/20 0.33
NFKB1 P19838 1/20 0.32
PMP22 Q01453 1/20 0.32
FFAR3 O14843 1/20 0.31
HDAC3 O15379 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC2 Q92769 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
SCHEMBL6059543 0.75 ALDH1A1 (0.42) ALDH1A1TSHRTDP1
SCHEMBL4555671 0.66 LMNA (0.47) KMT2AALDH1A1MEN1CYP1A2THRB
SCHEMBL4810549 0.66 LMNA (0.47) KMT2AALDH1A1MEN1CYP1A2THRB
SCHEMBL14963643 0.64 LMNA (0.53) KMT2AALDH1A1MEN1CYP1A2THRB
SCHEMBL1975990 0.64 LMNA (0.44) KMT2AALDH1A1MEN1CYP1A2THRB
SCHEMBL3737169 0.64 LMNA (0.44) KMT2AALDH1A1MEN1CYP1A2THRB
SCHEMBL3105548 0.64 ALDH1A1 (0.52) KMT2AALDH1A1MEN1CYP1A2THRB
Succinic Acid SCHEMBL18916897 0.62
SCHEMBL1712383 0.62
SCHEMBL5795120 0.62 LMNA (0.50) KMT2AALDH1A1MEN1CYP1A2THRB

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
US-6613733-B1 Starch-free; derivatized polysaccharide, oligosaccharide and/or monosaccharide; wrinkle, wear, aging, and pilling resistance; shrinkage inhibition; fabrics THE PROCTER & GAMBLE COMPANY 2003-09-02 US disclosed
US-6184197-B1 LAUNDRY DETERGENT COMPRISING A POLYVINYLPYRROLIDONE OR POLYVINYLIMIDAZOLE POLYMER WHOSE NITROGEN ATOM(S) ARE LINKED TO AN ACTIVE ALCOHOL ESTER GROUP OF GIVEN FORMULA, SURFACTANT, CARRIERS, AND ADJUVANTS; DELAYED RELEASE PERFUME THE PROCTER & GAMBLE COMPANY 2001-02-06 US disclosed