SCHEMBL3206063

SCHEMBL3206063

CC(O)CCCCO[Si](C)(C)C(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
DUT P33316 1/20 0.35
MAPK1 P28482 1/20 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
SCHEMBL31644643 1.00 DUT (0.35) DUTMAPK1
SCHEMBL31644831 1.00 DUT (0.35) DUTMAPK1
SCHEMBL15902883 0.98 DUT (0.34) DUT
SCHEMBL6379670 0.98 DUT (0.34) DUT
SCHEMBL11292040 0.98 DUT (0.34) DUT
SCHEMBL3605071 0.94 DUT (0.36) DUTMAPK1
SCHEMBL6393715 0.94 DUT (0.36) DUTMAPK1
SCHEMBL31644722 0.94 DUT (0.36) DUTMAPK1
SCHEMBL1313910 0.86 MAPK1 (0.33) DUTMAPK1
SCHEMBL1313907 0.86 MAPK1 (0.33) DUTMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8394995-B2 Process for preparation of carbonyl compound and pro-oxidant for preparation of carbonyl compound NATIONAL UNIVERSITY CORPORATION NAGOYA UNIVERSITY (JP) 2013-03-12 US disclosed
EP-2085373-B1 METHOD FOR PRODUCING CARBONYL COMPOUND AN PRO-OXIDANT USED FOR PRODUCTION OF CARBONYL COMPOUND UNIV NAGOYA NAT UNIV CORP (JP) 2013-01-16 EP disclosed
US-20100041917-A1 PROCESS FOR PREPARATION OF CARBONYL COMPOUND AND PRO-OXIDANT FOR PREPARATION OF CARBONYL COMPOUND NATIONAL UNIVERSITY CORPORATION NAGOYA UNIVERSITY (JP) 2010-02-18 US disclosed
EP-2085373-A1 METHOD FOR PRODUCING CARBONYL COMPOUND AN PRO-OXIDANT USED FOR PRODUCTION OF CARBONYL COMPOUND National University Corporation Nagoya University (JP) 2009-08-05 EP 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 (1 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-20100041917-A1 PROCESS FOR PREPARATION OF CARBONYL COMPOUND AND PRO-OXIDANT FOR PREPARATION OF CARBONYL COMPOUND CBR1, CBR3, NOX4 DUT 3372/4885MAPK1 497/4885

“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.