SCHEMBL3886019

SCHEMBL3886019

Cc1ccc(C(C)(C)OC(=O)CC(=O)OC(C)(C)c2ccc(C)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.49
RAB9A P51151 4/20 0.49
MAPT P10636 1/20 0.49
TDP1 Q9NUW8 2/20 0.42
TSHR P16473 1/20 0.41
ALDH1A1 P00352 1/20 0.41
GAA P10253 1/20 0.41
HDAC1 Q13547 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HPGD P15428 2/20 0.39
CNR1 P21554 1/20 0.38
CNR2 P34972 1/20 0.38
POLB P06746 2/20 0.38
LMNA P02545 2/20 0.37
MMP13 P45452 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
SCHEMBL12084053 0.92 RAB9A (0.46) NPC1RAB9AMAPTTSHRALDH1A1
SCHEMBL26958135 0.85 NPC1 (0.41) NPC1RAB9AMAPTTDP1TSHR
SCHEMBL3877091 0.83 POLB (0.47) NPC1RAB9AMAPTALDH1A1GAA
SCHEMBL3880018 0.82 ALDH1A1 (0.52) MAPTALDH1A1HDAC1HDAC6CNR1
SCHEMBL2467269 0.81 ALDH1A1 (0.54) NPC1RAB9AMAPTTDP1ALDH1A1
SCHEMBL24506162 0.80 TSHR (0.44) NPC1RAB9AMAPTTDP1TSHR
SCHEMBL11965904 0.80 HSD17B10 (0.39) NPC1RAB9AMAPTTDP1TSHR
SCHEMBL4459027 0.80 LMNA (0.47) NPC1RAB9AMAPTTDP1TSHR
SCHEMBL25900924 0.80 CA1 (0.36) NPC1RAB9AMAPTTDP1TSHR
SCHEMBL28912777 0.79 ALDH1A1 (0.51) NPC1RAB9AMAPTTDP1ALDH1A1

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 NPC1 2923/4885RAB9A 2289/4885MAPT 1001/4885
US-20090280245-A1 DECOMPOSABLE VEHICLES IN PRINTING OR COATING COMPOSITIONS ADH1C, ADH1A, MAL2 NPC1 3026/4885RAB9A 1829/4885MAPT 806/4885

“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.