SCHEMBL15319871

SCHEMBL15319871

CC(C)(C)OC(=O)N1CC(=O)C=C(CCO[Si](C)(C)C(C)(C)C)[C@H]1CO[Si](C)(C)C(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
ALDH1A1 P00352 3/20 0.33
FKBP1A P62942 1/20 0.32
TOP2A P11388 1/20 0.31
PTPN1 P18031 1/20 0.31
TSHR P16473 2/20 0.31
AR P10275 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
DUT P33316 2/20 0.31
LMNA P02545 1/20 0.30
ATM Q13315 2/20 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
SCHEMBL15319869 1.00 KMT2A (0.36) KMT2AMEN1ALDH1A1FKBP1ATOP2A
SCHEMBL19752920 0.91 MEN1 (0.43) KMT2AMEN1ALDH1A1DUTATM
SCHEMBL16559037 0.91 MEN1 (0.36) KMT2AMEN1ALDH1A1L3MBTL1DUT
SCHEMBL15320018 0.90 KMT2A (0.37) KMT2AMEN1ALDH1A1FKBP1ATOP2A
SCHEMBL15320022 0.90 KMT2A (0.37) KMT2AMEN1ALDH1A1FKBP1ATOP2A
SCHEMBL15319966 0.85 KMT2A (0.38) KMT2AMEN1ALDH1A1FKBP1ATOP2A
SCHEMBL15319968 0.85 KMT2A (0.38) KMT2AMEN1ALDH1A1FKBP1ATOP2A
SCHEMBL15318882 0.82 KMT2A (0.36) KMT2AMEN1ALDH1A1FKBP1ATOP2A
SCHEMBL15319563 0.82 KMT2A (0.36) KMT2AMEN1ALDH1A1FKBP1ATOP2A
SCHEMBL15319566 0.82 KMT2A (0.36) KMT2AMEN1ALDH1A1FKBP1ATOP2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2834239-B1 HETEROBICYCLIC COMPOUNDS AS BETA-LACTAMASE INHIBITORS ENTASIS THERAPEUTICS LTD (GB) 2017-12-27 EP disclosed
US-9623014-B2 β-lactamase inhibitor compounds ENTASIS THERAPEUTICS LIMITED (GB) 2017-04-18 US disclosed
US-20160175290-A1 BETA-LACTAMASE INHIBITOR COMPOUNDS ASTRAZENECA PHARMACEUTICALS LP 2016-06-23 US disclosed
US-9309245-B2 Beta-lactamase inhibitor compounds ENTASIS THERAPEUTICS LIMITED (GB) 2016-04-12 US disclosed
US-20150073011-A1 Beta-Lactamase Inhibitor Compounds ASTRAZENECA AB (SE) 2015-03-12 US disclosed
EP-2834239-A1 HETEROBICYCLIC COMPOUNDS AS BETA-LACTAMASE INHIBITORS Astrazeneca AB (SE) 2015-02-11 EP disclosed
WO-2013150296-A1 HETEROBICYCLIC COMPOUNDS AS BETA-LACTAMASE INHIBITORS ASTRAZENECA AB (SE) 2013-10-10 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-20160175290-A1 BETA-LACTAMASE INHIBITOR COMPOUNDS LCT, MGAM, SI KMT2A 1304/4885MEN1 3098/4885ALDH1A1 319/4885
US-20150073011-A1 Beta-Lactamase Inhibitor Compounds LCT, MGAM, SI KMT2A 1304/4885MEN1 3098/4885ALDH1A1 319/4885

“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.