SCHEMBL4094284

SCHEMBL4094284

COC(=O)C1(NC(=O)OC(C)(C)C)CCC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.44
ALDH1A1 P00352 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
MEN1 O00255 1/20 0.36
MAPK1 P28482 1/20 0.36
KMT2A Q03164 1/20 0.36
NPSR1 Q6W5P4 1/20 0.35
PPIA P62937 2/20 0.35
DGAT1 O75907 1/20 0.34
BTK Q06187 1/20 0.34
GHSR Q92847 1/20 0.34
GAA P10253 1/20 0.33
CTSL P07711 1/20 0.33
EPHX1 P07099 1/20 0.33
CA12 O43570 1/20 0.33
CA2 P00918 1/20 0.33
CA14 Q9ULX7 1/20 0.33
APLNR P35414 1/20 0.33
HSD11B1 P28845 1/20 0.32
NFKB1 P19838 1/20 0.32

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
SCHEMBL1350921 0.96 MAPT (0.47) MAPTALDH1A1L3MBTL1MEN1MAPK1
SCHEMBL978565 0.95 MAPT (0.50) MAPTALDH1A1L3MBTL1MEN1MAPK1
SCHEMBL1353132 0.95 MAPT (0.50) MAPTALDH1A1L3MBTL1MEN1MAPK1
SCHEMBL1820679 0.93 MAPT (0.39) MAPTALDH1A1L3MBTL1MEN1MAPK1
SCHEMBL5097256 0.87 MAPT (0.34) MAPTALDH1A1L3MBTL1MEN1MAPK1
SCHEMBL5197158 0.86 MAPT (0.39) MAPTALDH1A1L3MBTL1MEN1MAPK1
SCHEMBL18482797 0.86 MAPT (0.36) MAPTALDH1A1L3MBTL1MEN1MAPK1
SCHEMBL387928 0.85 KMT2A (0.39) MAPTALDH1A1L3MBTL1MEN1MAPK1
SCHEMBL2745968 0.85 USP2 (0.37) MAPTALDH1A1L3MBTL1MEN1MAPK1
SCHEMBL2746255 0.85 MAPT (0.35) MAPTALDH1A1L3MBTL1MEN1MAPK1

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
WO-2017017630-A1 NOVEL BETULINIC SUBSTITUTED AMIDE DERIVATIVES AS HIV INHIBITORS HETERO RESEARCH FOUNDATION (IN) 2017-02-02 WO disclosed
WO-2017017630-A1 NOVEL BETULINIC SUBSTITUTED AMIDE DERIVATIVES AS HIV INHIBITORS HETERO RESEARCH FOUNDATION (IN) 2017-02-02 WO disclosed
US-8030309-B2 Viral polymerase inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-10-04 US disclosed
US-20110015203-A1 Viral Polymerase Inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-01-20 US disclosed
CN-101400660-A Triazole derivative or salt thereof ASTELLAS PHARMA INC (JP) 2009-04-01 CN disclosed
US-20090082367-A1 TRIAZOLE DERIVATIVE OR A SALT THEREOF ASTELLAS PHARMA INC. (JP) 2009-03-26 US disclosed
EP-1995243-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF Astellas Pharma Inc. (JP) 2008-11-26 EP disclosed
US-7264792-B2 Solid phase preparation of 18F-labelled amino acids GE HEALTHCARE LIMITED (GB) 2007-09-04 US disclosed
EP-1572601-B1 SOLID-PHASE PREPARATION OF 18 F-LABELLED AMINO ACIDS GE HEALTHCARE LTD (GB) 2007-08-15 EP disclosed
US-20060039855-A1 Solid phase preparation of 18f-labelled amino acids GE HEALTHCARE LIMITED (GB) 2006-02-23 US disclosed
EP-1572601-A1 SOLID-PHASE PREPARATION OF 18 F-LABELLED AMINO ACIDS GE Healthcare Limited (GB) 2005-09-14 EP disclosed
WO-2004056725-A1 SOLID-PHASE PREPARATION OF 18F-LABELLED AMINO ACIDS GE HEALTHCARE LIMITED (GB) 2004-07-08 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 (3 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-20060039855-A1 Solid phase preparation of 18f-labelled amino acids SLC7A5, SLC43A1, SLCO2B1 MAPT 1079/4885ALDH1A1 2918/4885L3MBTL1 1833/4885
US-20110015203-A1 Viral Polymerase Inhibitors POLR2A, POLR1E, RPP30 MAPT 69/4885ALDH1A1 1822/4885L3MBTL1 1210/4885
US-20090082367-A1 TRIAZOLE DERIVATIVE OR A SALT THEREOF HSD11B1, HSD11B2, HSD17B1 MAPT 3869/4885ALDH1A1 389/4885L3MBTL1 1809/4885

“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.