SCHEMBL2600799

SCHEMBL2600799

CC(=O)COC(=O)CCCCCOCCOCC(=O)OCC(=O)O

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PAM P19021 2/20 0.54
CES2 O00748 2/20 0.45
DGKA P23743 1/20 0.39
ALDH1A1 P00352 1/20 0.36
PRSS1 P07477 1/20 0.35
PRSS2 P07478 1/20 0.35
PRSS3 P35030 1/20 0.35
PLA2G4B P0C869 2/20 0.35
DNM1 Q05193 1/20 0.33
CYP2C19 P33261 1/20 0.33
EPHX2 P34913 2/20 0.32
GAA P10253 1/20 0.31
TSHR P16473 1/20 0.31
MAPT P10636 1/20 0.31
PLA2G2C Q5R387 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
SCHEMBL12286302 0.97 PAM (0.57) PAMCES2DGKAALDH1A1PRSS1
SCHEMBL16300324 0.92 PAM (0.58) PAMCES2DGKAALDH1A1PRSS1
SCHEMBL2600794 0.89 PAM (0.61) PAMCES2DGKAALDH1A1PRSS1
SCHEMBL17463468 0.84 PAM (0.63) PAMDGKAALDH1A1DNM1EPHX2
SCHEMBL17463465 0.83 PAM (0.68) PAMDGKAALDH1A1DNM1TSHR
SCHEMBL3438976 0.79 CES2 (0.50) PAMCES2ALDH1A1PLA2G4BCYP2C19
SCHEMBL12286261 0.78 PAM (0.44) PAMCES2GAATSHR
SCHEMBL11837895 0.78 PAM (0.57) PAMCES2DGKAALDH1A1PRSS1
SCHEMBL15445502 0.78 PAM (0.47) PAMDGKAALDH1A1PRSS1PRSS2
SCHEMBL12287044 0.77 PAM (0.51) PAMCES2DGKAALDH1A1PRSS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130035402-A1 BIOABSORBABLE POLYESTERAMIDES AND USES THEREOF BEZWADA BIOMEDICAL, LLC (US) 2013-02-07 US disclosed
US-8309132-B2 Bioabsorbable polyesteramides and uses thereof BEZWADA BIOMEDICAL, LLC (US) 2012-11-13 US disclosed
US-8163806-B2 Controlled release of biologically active compounds from multi-armed oligomers BEZWADA BIOMEDICAL, LLC (US) 2012-04-24 US disclosed
US-20120010284-A1 CONTROLLED RELEASE OF BIOLOGICALLY ACTIVE COMPOUNDS FROM MULTI-ARMED OLIGOMERS BEZWADA BIOMEDICAL, LLC (US) 2012-01-12 US disclosed
US-8026285-B2 Control release of biologically active compounds from multi-armed oligomers BEZWADA BIOMEDICAL, LLC (US) 2011-09-27 US disclosed
US-20090285896-A1 BIOABSORBABLE POLYESTERAMIDES AND USES THEREOF BEZWADA BIOMEDICAL, LLC (US) 2009-11-19 US disclosed
US-20090076174-A1 CONTROL RELEASE OF BIOLOGICALLY ACTIVE COMPOUNDS FROM MULTI-ARMED OLIGOMERS BEZWADA BIOMEDICAL, LLC (US) 2009-03-19 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090076174-A1 CONTROL RELEASE OF BIOLOGICALLY ACTIVE COMPOUNDS FROM MULTI-ARMED OLIGOMERS MME, CTSA, ALG1 PAM 587/4885CES2 847/4885DGKA 3158/4885
US-20090285896-A1 BIOABSORBABLE POLYESTERAMIDES AND USES THEREOF PAICS, UROD, PUF60 PAM 22/4885CES2 2919/4885DGKA 926/4885
US-20120010284-A1 CONTROLLED RELEASE OF BIOLOGICALLY ACTIVE COMPOUNDS FROM MULTI-ARMED OLIGOMERS MME, AADAC, LGMN PAM 534/4885CES2 828/4885DGKA 3147/4885
US-20130035402-A1 BIOABSORBABLE POLYESTERAMIDES AND USES THEREOF PAICS, UROD, PUF60 PAM 22/4885CES2 2919/4885DGKA 926/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.