SCHEMBL1005735

SCHEMBL1005735

COc1ccc(C=Cc2ccc([N+](=O)[O-])cc2)cc1

nearest known ligand 0.78

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 6/20 0.78
PTGS1 P23219 2/20 0.78
NFE2L2 Q16236 1/20 0.71
MAOA P21397 1/20 0.70
MAOB P27338 1/20 0.70
TLR9 Q9NR96 1/20 0.70
CYP19A1 P11511 1/20 0.66
FBP1 P09467 2/20 0.66
SNCA P37840 1/20 0.59
APP P05067 2/20 0.58
MAPT P10636 2/20 0.58
NPC1 O15118 1/20 0.58
RAB9A P51151 1/20 0.58
TRPA1 O75762 1/20 0.55

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
SCHEMBL1005734 1.00 PTGS2 (0.78) PTGS2PTGS1NFE2L2MAOAMAOB
SCHEMBL10728549 0.93 APP (0.70) PTGS2PTGS1NFE2L2MAOAMAOB
SCHEMBL10728554 0.93 APP (0.70) PTGS2PTGS1NFE2L2MAOAMAOB
SCHEMBL9785831 0.91 NFE2L2 (0.83) PTGS2PTGS1NFE2L2MAOAMAOB
SCHEMBL9785833 0.91 NFE2L2 (0.83) PTGS2PTGS1NFE2L2MAOAMAOB
SCHEMBL14880486 0.89 PTGS2 (0.63) PTGS2PTGS1NFE2L2MAOAMAOB
SCHEMBL20328414 0.88 APP (0.70) PTGS2PTGS1NFE2L2MAOAMAOB
SCHEMBL492221 0.88 APP (0.70) PTGS2PTGS1NFE2L2MAOAMAOB
SCHEMBL20328415 0.88 APP (0.70) PTGS2PTGS1NFE2L2MAOAMAOB
SCHEMBL4733440 0.88 PTGS2 (1.00) PTGS2PTGS1NFE2L2MAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230226195-A1 TARGETED ABERRANT ALPHA-SYNUCLEIN SPECIES AND INDUCED UBIQUITINATION AND PROTEOSOMAL CLEARANCE VIA CO-RECRUITMENT OF AN E3-LIGASE SYSTEM DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-07-20 US disclosed
WO-2021074275-A1 EFFECTIVE PHOTOMODULATION OF LANTHANIDE (III) ION LUMINESCENCE IN THE VISIBLE OR NEAR-INFRARED RANGE UNIVERSITE DE RENNES 1 (FR) 2021-04-22 WO disclosed
US-9868873-B2 Photochromic security enabled ink for digital offset printing applications XEROX CORPORATION (US) 2018-01-16 US disclosed
US-9831417-B2 Poling treatment method, magnetic field poling device, and piezoelectric film YOUTEC CO., LTD. (JP) 2017-11-28 US disclosed
US-9575246-B2 Prepolymer, curable material, coating composition, non-linear optical material, optical waveguide and light control device ASAHI GLASS COMPANY, LIMITED (JP) 2017-02-21 US disclosed
EP-2889684-A1 PREPOLYMER, CURABLE MATERIAL, COATING COMPOSITION, NON-LINEAR OPTICAL MATERIAL, OPTICAL WAVEGUIDE AND LIGHT CONTROL DEVICE Asahi Glass Company, Limited (JP) 2015-07-01 EP disclosed
US-20150153509-A1 PREPOLYMER, CURABLE MATERIAL, COATING COMPOSITION, NON-LINEAR OPTICAL MATERIAL, OPTICAL WAVEGUIDE AND LIGHT CONTROL DEVICE ASAHI GLASS COMPANY, LIMITED (JP) 2015-06-04 US disclosed
US-20140319405-A1 POLING TREATMENT METHOD, MAGNETIC FIELD POLING DEVICE, AND PIEZOELECTRIC FILM KRYSTAL INC. (JP) 2014-10-30 US disclosed
US-20140191618-A1 POLING TREATMENT METHOD, PLASMA POLING DEVICE, PIEZOELECTRIC BODY AND MANUFACTURING METHOD THEREOF, FILM FORMING DEVICE AND ETCHING DEVICE, AND LAMP ANNEALING DEVICE YOUTEC CO., LTD. (JP) 2014-07-10 US disclosed
US-20130305947-A1 PHOTOCHROMIC SECURITY ENABLED INK FOR DIGITAL OFFSET PRINTING APPLICATIONS XEROX CORPORATION (US) 2013-11-21 US disclosed
US-5015417-A Electrooptical apparatus, liquid crystals, modulators E. I. DU PONT DE NEMOURS AND COMPANY (US) 1991-05-14 US disclosed
WO-1991003458-A1 NONLINEAR OPTICAL DEVICE FROM 3-METHYL-4-METHOXY-4'-NITROSTILBENE E.I. DU PONT DE NEMOURS AND COMPANY (US) 1991-03-21 WO disclosed
US-4985179-A VINYLIDENE CYANIDE COPOLYMER, ORGANIC CRYSTAL MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1991-01-15 US disclosed
US-4985178-A Nonlinear optical device from 3-methyl-4-methoxy-4'-nitrostilbene E. I. DU PONT DE NEMOURS AND COMPANY (US) 1991-01-15 US disclosed
US-4966730-A CAPABILITY OF SECOND HARMONIC GENERATION USING ELECTROOPTICAL MODULAR E. I. DU PONT DE NEMOURS AND COMPANY (US) 1990-10-30 US disclosed
US-4961631-A Nonlinear optical devices from derivatives of stilbene E. I DU PONT DE NEMOURS AND COMPANY (US) 1990-10-09 US disclosed
US-4909964-A With optical light source and means to direct radiation E. I. DUPONT DE NEMOURS AND COMPANY (US) 1990-03-20 US disclosed
EP-0344735-A2 Non-linear optical material MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1989-12-06 EP disclosed
US-4004573-A Process and apparatus for solar energy collection and retrieval BATTELLE DEVELOPMENT CORPORATION (US) 1977-01-25 US disclosed
US-4004572-A Solar energy collection and retrieval employing reversible photochemical isomerization BATTELLE DEVELOPMENT CORPORATION (US) 1977-01-25 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 (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-20230226195-A1 TARGETED ABERRANT ALPHA-SYNUCLEIN SPECIES AND INDUCED UBIQUITINATION AND PROTEOSOMAL CLEARANCE VIA CO-RECRUITMENT OF AN E3-LIGASE SYSTEM SNCA, ADRM1, UBE3C PTGS2 4627/4885PTGS1 4668/4885NFE2L2 985/4885

“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.