Sugi Predict

Sugi Predict / Compounds / SCHEMBL70447

SCHEMBL70447

SCHEMBL70447

O=[N+]([O-])c1cc(O)cc([N+](=O)[O-])c1O

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GPR35 Q9HC97 9/20 0.67
▸ CRHBP P24387 1/20 0.57
▸ CRHR2 Q13324 1/20 0.57
▸ CA12 O43570 1/20 0.57
▸ CA1 P00915 1/20 0.57
▸ CA2 P00918 1/20 0.57
▸ CA9 Q16790 1/20 0.57
▸ ALDH1A1 P00352 2/20 0.56
▸ KDM4E B2RXH2 1/20 0.56
▸ MEN1 O00255 1/20 0.56
▸ TTR P02766 1/20 0.56
▸ CYP1A2 P05177 1/20 0.56
▸ MAPT P10636 1/20 0.56
▸ CYP2C9 P11712 1/20 0.56
▸ HPGD P15428 1/20 0.56
▸ ALOX15 P16050 1/20 0.56
▸ ALOX12 P18054 1/20 0.56
▸ MAPK1 P28482 1/20 0.56
▸ RECQL P46063 1/20 0.56
▸ PMP22 Q01453 1/20 0.56

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
Methoxymethane SCHEMBL9777340 0.91 GPR35 (0.63) GPR35CRHBPCRHR2CA12CA1
SCHEMBL18306136 0.88 TTR (0.67) GPR35CA12CA1CA2CA9
SCHEMBL10885499 0.84 CRHBP (0.76) GPR35CRHBPCRHR2CA12CA1
Trinitrophenol SCHEMBL253750 0.82 GPR35 (0.79) GPR35CRHBPCRHR2CA12CA1
SCHEMBL11793625 0.82 GPR35 (0.48) GPR35CRHBPCRHR2ALDH1A1KDM4E
Trinitrophenol SCHEMBL8744 0.82 GPR35 (0.79) GPR35CRHBPCRHR2CA12CA1
SCHEMBL1283748 0.81 GPR35 (0.64) GPR35CRHBPCRHR2CA12CA1
Trinitrophenol SCHEMBL2197458 0.80 GPR35 (0.76) GPR35CRHBPCRHR2CA12CA1
Trinitrophenol SCHEMBL18691159 0.80 GPR35 (0.76) GPR35CRHBPCRHR2CA12CA1
Trinitrophenol SCHEMBL9140811 0.80 GPR35 (0.76) GPR35CRHBPCRHR2CA12CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11673997-B2 Work time to walk-on time ratio by adding a phenolic catalyst to polyaspartic flooring formulations COVESTRO LLC (US) 2023-06-13 — — US claimed
CN-114144454-A Improved operating time to open-run time ratio by adding phenolic catalysts to polyaspartic flooring formulations 科思创有限公司 2022-03-04 — — CN claimed
US-20210032407-A1 WORK TIME TO WALK-ON TIME RATIO BY ADDING A PHENOLIC CATALYST TO POLYASPARTIC FLOORING FORMULATIONS COVESTRO LLC 2021-02-04 — — US claimed
CN-104193759-B A kind of 4-methylol-7-oxabicyclo [2.2.1] hept-5-alkene monomer and preparation method thereof 中国科学院宁波材料技术与工程研究所 2016-08-03 — — CN claimed
US-20120296123-A1 FLUOROETHER-FUNCTIONALIZED NITROAROMATIC COMPOUNDS AND DERIVATIVES THEREOF E.I. DU PONT DE NEMOURS AND COMPANY (US) 2012-11-22 — — US claimed
US-20120296122-A1 FLUOROETHER-FUNCTIONALIZED AMINOAROMATIC COMPOUNDS AND DERIVATIVES THEREOF E. I. DU PONT DE NEMOURS AND COMPANY (US) 2012-11-22 — — US claimed
WO-2012158302-A2 FLUOROETHER-FUNCTIONALIZED NITROAROMATIC COMPOUNDS AND DERIVATIVES THEREOF E. I. DU PONT DE NEMOURS AND COMPANY (US) 2012-11-22 — — WO claimed
WO-2012158303-A2 FLUOROETHER-FUNCTIONALIZED AMINOAROMATIC COMPOUNDS AND DERIVATIVES THEREOF E. I. DU PONT DE NEMOURS AND COMPANY (US) 2012-11-22 — — WO claimed
US-20100168279-A1 THERMALLY CURABLE EPOXY-AMINE BARRIER SEALANTS HENKEL AG & CO. KGAA (DE) 2010-07-01 — — US claimed
EP-2001924-A1 THERMALLY CURABLE EPOXY-AMINE BARRIER SEALANTS National Starch and Chemical Investment Holding Corporation (US) 2008-12-17 — — EP claimed
WO-2007114822-A1 THERMALLY CURABLE EPOXY-AMINE BARRIER SEALANTS NATIONAL STARCH AND CHEMICAL INVESTMENT HOLDING CORPORATION (US) 2007-10-11 — — WO claimed
WO-1998059016-A1 COMPOSITION AND METHOD FOR INHIBITING RADICAL POLYMERISATION OF ETHYLENICALLY UNSATURATED AROMATIC MONOMERS RHODIA CHIMIE (FR) 1998-12-30 — — WO claimed
US-20250257167-A1 EXTENDED WORK TIME POLYASPARTIC FLOOR COATING FORMULATIONS COVESTRO LLC 2025-08-14 — — US disclosed
EP-4526362-A1 EXTENDED WORK TIME POLYASPARTIC FLOOR COATING FORMULATIONS Covestro LLC (US) 2025-03-26 — — EP disclosed
CN-114144454-B Improved handling time to open walk time ratio by adding phenolic catalyst to polyaspartic floor formulation 科思创有限公司 2025-02-14 — — CN disclosed
CN-119301171-A Polyaspartic floor coating formulation with extended handling time 科思创有限公司 2025-01-10 — — CN disclosed
WO-2003060192-A1 NON-TOXIC CORROSION-PROTECTION RINSES AND SEALS BASED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 — — WO disclosed
WO-1998059016-A1 COMPOSITION AND METHOD FOR INHIBITING RADICAL POLYMERISATION OF ETHYLENICALLY UNSATURATED AROMATIC MONOMERS RHODIA CHIMIE (FR) 1998-12-30 — — WO disclosed
EP-0633915-B1 A METHOD AND LIQUID COMPOSITION FOR THE PRODUCTION OF INDELIBLE SCRIPT ON A PAPER SUBSTRATE SEGALLA GABRIELE (IT) 1998-02-04 — — EP disclosed
US-5637354-A USING OXIDATIVE FIBER REACTIVE DYE SEGALLA GABRIELE (IT) 1997-06-10 — — 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 (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-20120296123-A1 FLUOROETHER-FUNCTIONALIZED NITROAROMATIC COMPOUNDS AND DERIVATIVES THEREOF PFAS, PARG, PARN GPR35 3412/4885CRHBP 3322/4885CRHR2 2856/4885
US-20120296122-A1 FLUOROETHER-FUNCTIONALIZED AMINOAROMATIC COMPOUNDS AND DERIVATIVES THEREOF PARG, PARN, AADAC GPR35 3445/4885CRHBP 3035/4885CRHR2 2050/4885

“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.