SCHEMBL9663237

SCHEMBL9663237

O=C(O)C1CCCCCC1C(=O)OC(=O)C1CCCCCC1C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PEPD P12955 1/20 0.42
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
TP53 P04637 1/20 0.39
CYP3A4 P08684 1/20 0.39
MEN1 O00255 1/20 0.39
BLM P54132 1/20 0.39
KMT2A Q03164 1/20 0.39
GRM4 Q14833 1/20 0.38
KDM4E B2RXH2 1/20 0.37
HTT P42858 1/20 0.37
SMN1; SMN2 Q16637 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
SCHEMBL10739888 1.00 PEPD (0.42) PEPDALDH1A1LMNATP53CYP3A4
SCHEMBL11660179 1.00 PEPD (0.42) PEPDALDH1A1LMNATP53CYP3A4
SCHEMBL130870 0.98 PEPD (0.43) PEPDALDH1A1LMNATP53CYP3A4
SCHEMBL10578737 0.98 PEPD (0.43) PEPDALDH1A1LMNATP53CYP3A4
SCHEMBL34169 0.98 PEPD (0.43) PEPDALDH1A1LMNATP53CYP3A4
SCHEMBL598373 0.98 PEPD (0.43) PEPDALDH1A1LMNATP53CYP3A4
Bicarbonate SCHEMBL8981886 0.95 ALDH1A1 (0.46) PEPDALDH1A1LMNATP53CYP3A4
SCHEMBL7031195 0.95 PEPD (0.42) PEPDALDH1A1LMNATP53CYP3A4
SCHEMBL336245 0.93 PEPD (0.48) PEPDALDH1A1LMNATP53CYP3A4
SCHEMBL4464323 0.93 PEPD (0.48) PEPDALDH1A1LMNATP53CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0467903-B1 PROCESS FOR THE PREPARATION OF CHLORINE-RESISTANT POLYESTER SEMIPERMEABLE MEMBRANES AlliedSignal Inc. (US) 1992-12-30 EP disclosed
EP-0467903-A1 PROCESS FOR THE PREPARATION OF CHLORINE-RESISTANT POLYESTER SEMIPERMEABLE MEMBRANES. ALLIED SIGNAL INC (US) 1992-01-29 EP disclosed
US-5013448-A Acid catalyzed esterification of polyhydroxy alkyl acrylate and polymeric carboxylic acid ALLIED-SIGNAL INC. (US) 1991-05-07 US disclosed
WO-1990011821-A1 PROCESS FOR THE PREPARATION OF CHLORINE-RESISTANT POLYESTER SEMIPERMEABLE MEMBRANES ALLIED-SIGNAL INC. (US) 1990-10-18 WO disclosed