SCHEMBL3877091

SCHEMBL3877091

CC(C)(OC(=O)CC(=O)OC(C)(C)c1ccc(Cl)cc1)c1ccc(Cl)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.47
MEN1 O00255 6/20 0.45
KMT2A Q03164 6/20 0.45
CYP1A2 P05177 3/20 0.44
CYP2C19 P33261 3/20 0.44
GRIN2D O15399 1/20 0.44
GRIN3B O60391 1/20 0.44
GRIN1 Q05586 1/20 0.44
GRIN2A Q12879 1/20 0.44
GRIN2B Q13224 1/20 0.44
GRIN2C Q14957 1/20 0.44
GRIN3A Q8TCU5 1/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
NPSR1 Q6W5P4 1/20 0.43
MIF P14174 1/20 0.43
MAPT P10636 3/20 0.42
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 1/20 0.41

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
SCHEMBL12084053 0.93 RAB9A (0.46) POLBMEN1KMT2ACYP1A2CYP2C19
SCHEMBL28226851 0.87 MEN1 (0.44) POLBMEN1KMT2ACYP1A2CYP2C19
SCHEMBL28394495 0.86 GRIN2D (0.45) POLBMEN1KMT2ACYP1A2CYP2C19
SCHEMBL3886019 0.83 NPC1 (0.49) POLBNPC1RAB9ASMN1; SMN2MAPT
SCHEMBL3880018 0.81 ALDH1A1 (0.52) POLBMEN1KMT2ACYP1A2CYP2C19
SCHEMBL2467269 0.80 ALDH1A1 (0.54) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL11965904 0.79 HSD17B10 (0.39) CYP2C19NPC1RAB9ASMN1; SMN2MAPT
SCHEMBL34461782 0.79 CYP2C19 (0.35) CYP2C19GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL28912777 0.77 ALDH1A1 (0.51) MEN1KMT2ACYP1A2CYP2C19NPC1
SCHEMBL2813866 0.76 HIF1A (0.37) KMT2ACYP1A2CYP2C19SMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120315393-A1 USE OF DECOMPOSABLE VEHICLES OR SOLVENTS IN PRINTING OR COATING COMPOSITIONS THE TECHNICAL UNIVERSITY OF DENMARK (DK) 2012-12-13 US claimed
EP-2010614-B1 DECOMPOSABLE VEHICLES IN PRINTING OR COATING COMPOSITIONS UNIV DENMARK TECH DTU (DK) 2013-08-14 EP disclosed
EP-2010614-B1 DECOMPOSABLE VEHICLES IN PRINTING OR COATING COMPOSITIONS UNIV DENMARK TECH DTU (DK) 2013-08-14 EP disclosed
US-20120315393-A1 USE OF DECOMPOSABLE VEHICLES OR SOLVENTS IN PRINTING OR COATING COMPOSITIONS THE TECHNICAL UNIVERSITY OF DENMARK (DK) 2012-12-13 US disclosed
US-20120315393-A1 USE OF DECOMPOSABLE VEHICLES OR SOLVENTS IN PRINTING OR COATING COMPOSITIONS THE TECHNICAL UNIVERSITY OF DENMARK (DK) 2012-12-13 US disclosed
US-20120315393-A1 USE OF DECOMPOSABLE VEHICLES OR SOLVENTS IN PRINTING OR COATING COMPOSITIONS THE TECHNICAL UNIVERSITY OF DENMARK (DK) 2012-12-13 US disclosed
US-8257786-B2 Decomposable vehicles in printing or coating compositions THE TECHNICAL UNIVERSITY OF DENMARK (DK) 2012-09-04 US disclosed
US-8257786-B2 Decomposable vehicles in printing or coating compositions THE TECHNICAL UNIVERSITY OF DENMARK (DK) 2012-09-04 US disclosed
US-8257786-B2 Decomposable vehicles in printing or coating compositions THE TECHNICAL UNIVERSITY OF DENMARK (DK) 2012-09-04 US disclosed
US-20090280245-A1 DECOMPOSABLE VEHICLES IN PRINTING OR COATING COMPOSITIONS THE TECHNICAL UNIVERSITY OF DENMARK (DK) 2009-11-12 US disclosed
US-20090280245-A1 DECOMPOSABLE VEHICLES IN PRINTING OR COATING COMPOSITIONS THE TECHNICAL UNIVERSITY OF DENMARK (DK) 2009-11-12 US disclosed
US-20090280245-A1 DECOMPOSABLE VEHICLES IN PRINTING OR COATING COMPOSITIONS THE TECHNICAL UNIVERSITY OF DENMARK (DK) 2009-11-12 US disclosed
EP-2010614-A1 DECOMPOSABLE VEHICLES IN PRINTING OR COATING COMPOSITIONS The Technical University of Denmark (DK) 2009-01-07 EP disclosed
WO-2007118850-A1 DECOMPOSABLE VEHICLES IN PRINTING OR COATING COMPOSITIONS THE TECHNICAL UNIVERSITY OF DENMARK (DK) 2007-10-25 WO disclosed
WO-2007118850-A1 DECOMPOSABLE VEHICLES IN PRINTING OR COATING COMPOSITIONS THE TECHNICAL UNIVERSITY OF DENMARK (DK) 2007-10-25 WO 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-20120315393-A1 USE OF DECOMPOSABLE VEHICLES OR SOLVENTS IN PRINTING OR COATING COMPOSITIONS C9, ADH1C, ADH1A POLB 1030/4885MEN1 580/4885KMT2A 1672/4885
US-20090280245-A1 DECOMPOSABLE VEHICLES IN PRINTING OR COATING COMPOSITIONS ADH1C, ADH1A, MAL2 POLB 1092/4885MEN1 455/4885KMT2A 1329/4885

“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.