SCHEMBL2952178

SCHEMBL2952178

CC(=O)C(C(C)=O)C(=O)OC(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.36
KMT2A Q03164 2/20 0.35
LMNA P02545 1/20 0.35
CA12 O43570 1/20 0.32
CA14 Q9ULX7 1/20 0.32
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA7 P43166 1/20 0.31
NOS1 P29475 2/20 0.31
GAA P10253 2/20 0.31
NOS3 P29474 1/20 0.31
NOS2 P35228 1/20 0.31
MEN1 O00255 1/20 0.31
SLC7A5 Q01650 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
SCHEMBL6822603 0.95 DGAT1 (0.36) DGAT1KMT2ALMNACA12CA14
SCHEMBL9250430 0.80 ELANE (0.40) KMT2ALMNACA12CA14CA1
SCHEMBL353409 0.78 MAPT (0.37) LMNAGAA
SCHEMBL11093713 0.78 LMNA (0.31) KMT2ALMNAGAA
SCHEMBL17243717 0.77 HTT (0.34) DGAT1KMT2ALMNACA12CA14
SCHEMBL1141948 0.77 CA12 (0.35) DGAT1KMT2ALMNACA12CA14
SCHEMBL19438184 0.77 BTK (0.36) KMT2AGAAMEN1
SCHEMBL2440492 0.75 FAAH (0.38) DGAT1KMT2ALMNACA12CA14
SCHEMBL3827638 0.75 LMNA (0.37) DGAT1KMT2ALMNACA12CA14
SCHEMBL5409743 0.75 NOS1 (0.36) DGAT1KMT2ALMNACA12CA14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7560550-B2 Method for the production of OH protected[4-(2.6-diamino-9H-purine-9-yl)-1.3-dioxolane-2-yl]methanol derivatives RFS PHARMA, LLC (US) 2009-07-14 US claimed
US-7763740-B2 Method for the production of mumbaistatin derivatives SANOFI-AVENTIS (FR) 2010-07-27 US disclosed
US-7560550-B2 Method for the production of OH protected[4-(2.6-diamino-9H-purine-9-yl)-1.3-dioxolane-2-yl]methanol derivatives RFS PHARMA, LLC (US) 2009-07-14 US disclosed
US-20090156836-A1 METHOD FOR THE PRODUCTION OF MUMBAISTATIN DERIVATIVES SANOFI-AVENTIS (FR) 2009-06-18 US disclosed
EP-2010474-A1 METHOD FOR THE PRODUCTION OF MUMBAISTATIN DERIVATIVES Sanofi-Aventis (FR) 2009-01-07 EP disclosed
WO-2007121822-A1 METHOD FOR THE PRODUCTION OF MUMBAISTATIN DERIVATIVES SANOFI-AVENTIS (DE) 2007-11-01 WO disclosed
US-20060211855-A1 Method for the production of oh protected{4-(2.6-diamino-9h-purine-9-yl)-1.3-dioxolane-2-yl] methanol derivatives WACKER CHEMIE AG (DE) 2006-09-21 US disclosed
EP-1212285-B1 METHOD OF PRODUCING 2-HYDROXYCARBOXYLIC ACID ESTERS ABBOTT GMBH & CO KG (DE) 2005-02-02 EP disclosed
US-6646152-B1 Decyclization of glycidyl ester using organoaluminum reagent; no side reactions ABBOTT GMBH & CO. KG (DE) 2003-11-11 US disclosed
EP-1212285-A1 METHOD OF PRODUCING 2-HYDROXYCARBOXYLIC ACID ESTERS BASF AKTIENGESELLSCHAFT (DE) 2002-06-12 EP disclosed
WO-2001019774-A1 METHOD OF PRODUCING 2-HYDROXYCARBOXYLIC ACID ESTERS BASF AKTIENGESELLSCHAFT (DE) 2001-03-22 WO disclosed
US-5338639-A Heat and moisture resistant stabilizers which give sharp, deeply colored images when developed BASF AKTIENGESELLSCHAFT (DE) 1994-08-16 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-20090156836-A1 METHOD FOR THE PRODUCTION OF MUMBAISTATIN DERIVATIVES MMAB, MLYCD, HMBS DGAT1 1554/4885KMT2A 924/4885LMNA 2612/4885
US-20060211855-A1 Method for the production of oh protected{4-(2.6-diamino-9h-purine-9-yl)-1.3-dioxolane-2-yl] methanol derivatives FUT6, FUT5, ST6GAL1 DGAT1 2384/4885KMT2A 1922/4885LMNA 488/4885

“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.