SCHEMBL2533653

SCHEMBL2533653

CC(C)(C)O[C@H]1CN(C(=O)OCC2c3ccccc3-c3ccccc32)[C@H]2[C@@H]1OC[C@@H]2O

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.36
FABP5 Q01469 3/20 0.34
FABP7 O15540 2/20 0.34
PARP1 P09874 1/20 0.34
GBA1 P04062 1/20 0.33
EPHX2 P34913 1/20 0.33
CASP1 P29466 1/20 0.33
TDP1 Q9NUW8 1/20 0.32
MDM4 O15151 1/20 0.32
TP53 P04637 1/20 0.32
KLK7 P49862 1/20 0.31

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
SCHEMBL2535446 1.00 KMT2A (0.36) KMT2AFABP5FABP7PARP1GBA1
SCHEMBL2533656 1.00 KMT2A (0.36) KMT2AFABP5FABP7PARP1GBA1
SCHEMBL8226093 0.91 KMT2A (0.38) KMT2AFABP5FABP7PARP1GBA1
SCHEMBL2533038 0.91 KMT2A (0.38) KMT2AFABP5FABP7PARP1GBA1
SCHEMBL2535254 0.91 KMT2A (0.38) KMT2AFABP5FABP7PARP1GBA1
SCHEMBL2533036 0.91 KMT2A (0.38) KMT2AFABP5FABP7PARP1GBA1
SCHEMBL1480821 0.87 KMT2A (0.40) KMT2AFABP5FABP7PARP1GBA1
SCHEMBL1481301 0.87 KMT2A (0.40) KMT2AFABP5FABP7PARP1GBA1
SCHEMBL1480822 0.87 KMT2A (0.40) KMT2AFABP5FABP7PARP1GBA1
SCHEMBL1480114 0.83 KMT2A (0.38) KMT2AFABP5FABP7PARP1GBA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8039641-B2 Tetrahydrofuro[3,2-b] pyrrol-3-one intermediates AMURA THERAPEUTICS LIMITED (GB) 2011-10-18 US disclosed
US-7803803-B2 Tetrahydrofuro[3,2-B] pyrrol-3-ones as cathepsin K inhibitors AMURA THERAPEUTICS LIMITED (GB) 2010-09-28 US disclosed
US-7799791-B2 Tetrahydrofuro(3,2-B) pyrrol-3-one derivatives as inhibitors of cysteine proteinases AMURA THERAPEUTICS LIMITED (GB) 2010-09-21 US disclosed
US-20090197817-A1 Tetrahdrofuro[3,2-B] pyrrol-3- one as cathepsin k inhibitors AMURA THERAPEUTICS LIMITED (GB) 2009-08-06 US disclosed
US-20090192322-A1 Tetrahydrofuro[3,2-b] pyrrol-3-one intermediates AMURA THERAPEUTICS LIMITED (GB) 2009-07-30 US disclosed
US-20090186831-A1 Tetrahydrofuro(3,2-B) pyrrol-3-one derivatives as inhibitors of cysteine proteinases AMURA THERAPEUTICS LIMITED (GB) 2009-07-23 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 (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-20090197817-A1 Tetrahdrofuro[3,2-B] pyrrol-3- one as cathepsin k inhibitors CTSS, CTSK, TMPRSS6 KMT2A 4105/4885FABP5 3363/4885FABP7 1119/4885
US-20090186831-A1 Tetrahydrofuro(3,2-B) pyrrol-3-one derivatives as inhibitors of cysteine proteinases TMPRSS6, CCR6, MMP8 KMT2A 4223/4885FABP5 3806/4885FABP7 1843/4885
US-20090192322-A1 Tetrahydrofuro[3,2-b] pyrrol-3-one intermediates CYP4F8, CYP2C8, AVPR1B KMT2A 3122/4885FABP5 3039/4885FABP7 2710/4885

“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.