SCHEMBL10051165

SCHEMBL10051165

CCOCC(=O)OCC(=O)C(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.35
MGAM O43451 1/20 0.34
GAA P10253 1/20 0.34
SI P14410 1/20 0.34
MGAM2 Q2M2H8 1/20 0.34
ALDH1A1 P00352 8/20 0.34
TSHR P16473 1/20 0.34
VDR P11473 1/20 0.33
TRPA1 O75762 1/20 0.32
HIF1A Q16665 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
LMNA P02545 1/20 0.31
HSD17B10 Q99714 1/20 0.31
KDM4E B2RXH2 1/20 0.31
POLB P06746 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
THRB P10828 1/20 0.31
AR P10275 1/20 0.30
HTT P42858 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
SCHEMBL13381003 0.84 MAPK1 (0.38) MAPK1SMN1; SMN2ALDH1A1TSHRVDR
SCHEMBL18651088 0.81 MAPK1 (0.34) MAPK1SMN1; SMN2
Hydrochloric Acid SCHEMBL23467006 0.78 MAPK1 (0.43) MAPK1SMN1; SMN2MGAMGAASI
SCHEMBL20061753 0.78 MAPK1 (0.43) MAPK1SMN1; SMN2ALDH1A1VDRKDM4E
Chloromethane SCHEMBL27511196 0.78 GAA (0.52) SMN1; SMN2MGAMGAASIMGAM2
SCHEMBL123093 0.77
SCHEMBL5579311 0.77 ALDH1A1 (0.46) MAPK1SMN1; SMN2ALDH1A1POLBL3MBTL1
SCHEMBL18651063 0.77 MAPK1 (0.42) MAPK1SMN1; SMN2ALDH1A1VDRKDM4E
SCHEMBL10019280 0.77 MAPK1 (0.42) MAPK1SMN1; SMN2ALDH1A1VDRHTT
Ether SCHEMBL28452342 0.75 GAA (0.55) SMN1; SMN2MGAMGAASIMGAM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8324343-B2 Preparation of biodegradable polyesters with low-burst properties by supercritical fluid extraction TOLMAR THERAPEUTICS, INC. (US) 2012-12-04 US disclosed
US-20120108511-A1 PREPARATION OF BIODEGRADABLE POLYESTERS WITH LOW-BURST PROPERTIES BY SUPERCRITICAL FLUID EXTRACTION QLT USA, INC. (US) 2012-05-03 US disclosed
US-20080194663-A1 Sustained release inserts; mixture of thermoplastic polyester, solvent and leuprolide acetate; prostate cancer QLT USA, INC. 2008-08-14 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 (2 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-20120108511-A1 PREPARATION OF BIODEGRADABLE POLYESTERS WITH LOW-BURST PROPERTIES BY SUPERCRITICAL FLUID EXTRACTION PLG, PGF, PUF60 MAPK1 3971/4885SMN1; SMN2 4215/4885MGAM 290/4885
US-20080194663-A1 Sustained release inserts; mixture of thermoplastic polyester, solvent and leuprolide acetate; prostate cancer LPXN, GNRHR, AR MAPK1 3574/4885SMN1; SMN2 1511/4885MGAM 728/4885

“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.