SCHEMBL6895047

SCHEMBL6895047

ONCc1ccc(O)cc1O

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TYR P14679 6/20 0.60
ALOX5 P09917 2/20 0.48
MEN1 O00255 2/20 0.46
MAPT P10636 2/20 0.46
KMT2A Q03164 2/20 0.46
TP53 P04637 1/20 0.46
CYP3A4 P08684 1/20 0.46
ALOX15 P16050 1/20 0.46
TSHR P16473 1/20 0.46
HTT P42858 1/20 0.46
TDP1 Q9NUW8 1/20 0.46

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
SCHEMBL14521268 0.84 TYR (0.62) TYRALOX5MEN1MAPTKMT2A
SCHEMBL5458032 0.80 TYR (0.58) TYRALOX5MEN1MAPTKMT2A
SCHEMBL20852016 0.80 TYR (0.58) TYRALOX5TSHR
SCHEMBL17715198 0.80 TYR (0.58) TYRALOX5MEN1MAPTKMT2A
SCHEMBL11510302 0.77 EGFR (0.72) TYRMEN1MAPTKMT2AALOX15
SCHEMBL51397 0.75 TYR (0.71) TYRALOX5MEN1MAPTKMT2A
SCHEMBL1397158 0.75 TYR (1.00) TYRALOX5MEN1MAPTKMT2A
SCHEMBL18255098 0.74 TYR (0.50) TYR
SCHEMBL647503 0.73 TYR (0.68) TYRALOX5MEN1MAPTKMT2A
SCHEMBL11512440 0.72 CA12 (0.61) TYRALOX5MEN1MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040110729-A1 Primary N-hydroxylamines NIH 2004-06-10 US claimed
US-6455589-B1 AN ORALLY ADMINISTRABLE EFFECTIVE UNIT SOLID DOSAGE OF A PRIMARY N-HYDROXYLAMINE OR A SALT, FREE OF NITRONE; USEFUL FOR REDUCING OXIDATIVE DAMAGE OR DELAYING SENESCENCE THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2002-09-24 US claimed
CN-106458871-B Nitrone compounds and their use in personal care 陶氏环球技术有限责任公司 2018-12-28 CN disclosed
EP-3142752-B1 NITRONE COMPOUNDS AND THEIR USE IN PERSONAL CARE DOW GLOBAL TECHNOLOGIES LLC (US) 2018-06-20 EP disclosed
US-9828335-B2 Nitrone compounds and their use in personal care DOW GLOBAL TECHNOLOGIES LLC (US) 2017-11-28 US disclosed
US-9796667-B2 Nitrone compounds and their use in personal care DOW GLOBAL TECHNOLOGIES LLC (US) 2017-10-24 US disclosed
US-20170253558-A1 NITRONE COMPOUNDS AND THEIR USE IN PERSONAL CARE DOW GLOBAL TECHNOLOGIES LLC 2017-09-07 US disclosed
US-9730874-B2 Nitrone compounds and their use in personal care DOW GLOBAL TECHNOLOGIES LLC (US) 2017-08-15 US disclosed
US-9701625-B2 Nitrone compounds and their use in personal care DOW GLOBAL TECHNOLOGIES LLC (US) 2017-07-11 US disclosed
US-20170190655-A1 NITRONE COMPOUNDS AND THEIR USE IN PERSONAL CARE DOW GLOBAL TECHNOLOGIES LLC 2017-07-06 US disclosed
US-20170079896-A1 NITRONE COMPOUNDS AND THEIR USE IN PERSONAL CARE DOW GLOBAL TECHNOLOGIES LLC 2017-03-23 US disclosed
EP-3142752-A1 NITRONE COMPOUNDS AND THEIR USE IN PERSONAL CARE Dow Global Technologies Llc (US) 2017-03-22 EP disclosed
CN-106458871-A Nitrone compounds and their use in personal care 陶氏环球技术有限责任公司 2017-02-22 CN disclosed
EP-3114110-A1 NITRONE COMPOUNDS AND THEIR USE IN PERSONAL CARE Dow Global Technologies LLC (US) 2017-01-11 EP disclosed
US-20160362361-A1 NITRONE COMPOUNDS AND THEIR USE IN PERSONAL CARE DOW GLOBAL TECHNOLOGIES LLC 2016-12-15 US disclosed
WO-2015175310-A1 NITRONE COMPOUNDS AND THEIR USE IN PERSONAL CARE DOW GLOBAL TECHNOLOGIES LLC (US) 2015-11-19 WO disclosed
WO-2015134688-A1 NITRONE COMPOUNDS AND THEIR USE IN PERSONAL CARE DOW GLOBAL TECHNOLOGIES LLC (US) 2015-09-11 WO disclosed
JP-2004315496-A FUSED HETEROCYCLIC RING COMPOUND TAKEDA CHEM IND LTD 2004-11-11 JP 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 (4 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-20160362361-A1 NITRONE COMPOUNDS AND THEIR USE IN PERSONAL CARE NOX1, NOX5, NOS1 TYR 243/4885ALOX5 791/4885MEN1 1140/4885
US-20170253558-A1 NITRONE COMPOUNDS AND THEIR USE IN PERSONAL CARE NOX1, NOX5, NOS1 TYR 243/4885ALOX5 791/4885MEN1 1140/4885
US-20170190655-A1 NITRONE COMPOUNDS AND THEIR USE IN PERSONAL CARE NOX1, NOX3, NOX5 TYR 271/4885ALOX5 874/4885MEN1 793/4885
US-20170079896-A1 NITRONE COMPOUNDS AND THEIR USE IN PERSONAL CARE NOX1, NOX5, NOX3 TYR 226/4885ALOX5 927/4885MEN1 901/4885

“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.