SCHEMBL39273

SCHEMBL39273

CCCC[N+]([O-])=Cc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
G6PD P11413 2/20 0.38
POLB P06746 1/20 0.38
GAA P10253 1/20 0.38
TDP1 Q9NUW8 2/20 0.38
LMNA P02545 1/20 0.38
TLR4 O00206 1/20 0.36
TLR2 O60603 1/20 0.36
ALDH1A1 P00352 5/20 0.35
FBP1 P09467 2/20 0.35
KMT2A Q03164 1/20 0.35
MAPT P10636 3/20 0.34
ALOX15 P16050 1/20 0.34
TSHR P16473 1/20 0.34
RECQL P46063 1/20 0.34
CES2 O00748 1/20 0.34
CES1 P23141 1/20 0.34
EGFR P00533 1/20 0.34
HDAC3 O15379 1/20 0.34
CNR1 P21554 1/20 0.34

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
SCHEMBL264463 1.00 G6PD (0.38) G6PDPOLBGAATDP1LMNA
SCHEMBL14575602 0.86 G6PD (0.41) G6PDPOLBGAATDP1ALDH1A1
SCHEMBL14575603 0.86 G6PD (0.41) G6PDPOLBGAATDP1ALDH1A1
SCHEMBL3454524 0.80 MEN1 (0.39) GAAALDH1A1KMT2AMAPT
SCHEMBL1404270 0.79 G6PD (0.42) G6PDPOLBGAATDP1ALDH1A1
SCHEMBL4712634 0.79 G6PD (0.41) G6PDPOLBGAATDP1ALDH1A1
SCHEMBL10696828 0.79 FBP1 (0.44) LMNAALDH1A1FBP1TSHREGFR
SCHEMBL9065978 0.76 AKR1C3 (0.47) TDP1LMNAALDH1A1FBP1KMT2A
SCHEMBL14617615 0.74 G6PD (0.45) G6PDPOLBGAATDP1ALDH1A1
SCHEMBL27374051 0.74 G6PD (0.39) G6PDPOLBGAATDP1ALDH1A1

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 258 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3340972-A1 METHOD OF TRANSPORTING AN AGENT ACROSS BLOOD-BRAIN, BLOOD-COCHLEAR OR BLOOD-CEREBROSPINAL FLUID BARRIER Oklahoma Medical Research Foundation (US) 2018-07-04 EP claimed
WO-2017048778-A1 METHOD OF TRANSPORTING AN AGENT ACROSS BLOOD-BRAIN, BLOOD-COCHLEAR OR BLOOD-CEREBROSPINAL FLUID BARRIER OKLAHOMA MEDICAL RESEARCH FOUNDATION (US) 2017-03-23 WO claimed
CN-105796602-A Treatment of stroke using isolated placental cells 人类起源公司 2016-07-27 CN claimed
EP-2574328-A2 Hair care compositions, methods, and articles of commerce that can increase the appearance of thicker and fuller hair The Procter and Gamble Company (US) 2013-04-03 EP claimed
US-20120258185-A1 HAIR CARE COMPOSITIONS, METHODS, AND ARTICLES OF COMMERCE THAT CAN INCREASE THE APPEARANCE OF THICKER AND FULLER HAIR OBLONG JOHN ERICH (US) 2012-10-11 US claimed
CN-102186971-A Treatment of stroke using isolated placental cells ANTHROGENESIS CORP 2011-09-14 CN claimed
US-20110071117-A1 COMBINATIONS OF ANTIOXIDANTS AND ANTI-INFLAMMATORY DRUGS IN THE TREATMENT OF INFLAMMATORY BOWEL DISEASE THE BOARD OF REGENTS OF THE UNIVERSITY OF OKLAHOMA (US) 2011-03-24 US claimed
WO-2009140457-A2 COMBINATIONS OF ANTIOXIDANTS AND ANTI-INFLAMMATORY DRUGS IN THE OF TREATMENT INFLAMMATORY BOWEL DISEASE THE BOARD OF REGENTS OF THE UNIVERSITY OF OKLAHOMA (US) 2009-11-19 WO claimed
CN-101511331-A Hair care compositions that can make hair appear thicker and fuller PROCTER & GAMBLE (US) 2009-08-19 CN claimed
EP-2056783-A2 HAIR CARE COMPOSITIONS THAT CAN INCREASE THE APPEARANCE OF THICKER AND FULLER HAIR The Procter and Gamble Company (US) 2009-05-13 EP claimed
US-RE35112-E Administering phenyl butyl nitrone or derivative in carrier in dosage to prevent or reverse oxidative central nervous system tissue damage OKLAHOMA MEDICAL RESEARCH FOUNDATION (US) 1995-12-05 US claimed
EP-0496796-B1 METHOD AND COMPOSITIONS FOR INHIBITION OF DISORDERS ASSOCIATED WITH OXIDATIVE DAMAGE OKLAHOMA MED RES FOUND (US) 1994-08-31 EP claimed
EP-0518951-A4 PHENYL BUTYL NITRONE COMPOSITIONS FOR PREVENTION OF GASTRIC ULCERATION 1993-02-24 EP claimed
EP-0518951-A1 PHENYL BUTYL NITRONE COMPOSITIONS FOR PREVENTION OF GASTRIC ULCERATION Oklahoma Medical Research Foundation (US) 1992-12-23 EP claimed
EP-0496796-A1 METHOD AND COMPOSITIONS FOR INHIBITION OF DISORDERS ASSOCIATED WITH OXIDATIVE DAMAGE. OKLAHOMA MED RES FOUND (US) 1992-08-05 EP claimed
WO-1991013618-A1 PHENYL BUTYL NITRONE COMPOSITIONS FOR PREVENTION OF GASTRIC ULCERATION OKLAHOMA MEDICAL RESEARCH FOUNDATION (US) 1991-09-19 WO claimed
US-5036097-A Antiinflammatory agents/non-steriodal OKLAHOMA MEDICAL RESEARCH FOUNDATION (US) 1991-07-30 US claimed
US-5025032-A For ischemia or inflammation of brain or nervous system OKLAHOMA MEDICAL RESEARCH FOUNDATION (US) 1991-06-18 US claimed
US-5017458-A Oxidation resistance HITACHI, LTD. (JP) 1991-05-21 US claimed
WO-1991005552-A1 METHOD AND COMPOSITIONS FOR INHIBITION OF DISORDERS ASSOCIATED WITH OXIDATIVE DAMAGE OKLAHOMA MEDICAL RESEARCH FOUNDATION (US) 1991-05-02 WO claimed

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-20120258185-A1 HAIR CARE COMPOSITIONS, METHODS, AND ARTICLES OF COMMERCE THAT CAN INCREASE THE APPEARANCE OF THICKER AND FULLER HAIR SHH, FSCN1, CUTA G6PD 3025/4885POLB 3443/4885GAA 4678/4885

“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.