SCHEMBL1005683

SCHEMBL1005683

CN(C)c1cccc(C=Cc2ccccc2)c1[N+](=O)[O-]

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 4/20 0.46
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
POLB P06746 1/20 0.43
CYP19A1 P11511 3/20 0.42
FBP1 P09467 1/20 0.41
RELA Q04206 1/20 0.41
APP P05067 1/20 0.41
MAPT P10636 3/20 0.40
TAAR1 Q96RJ0 1/20 0.40
ALDH1A1 P00352 2/20 0.40
LMNA P02545 2/20 0.40
HPGD P15428 2/20 0.40
MAPK1 P28482 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
S1PR4 O95977 1/20 0.39
HSP90AA1 P07900 1/20 0.39

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
SCHEMBL27736228 0.88 MAPT (0.47) NFE2L2MEN1KMT2APOLBCYP19A1
SCHEMBL1031262 0.86 NFE2L2 (0.44) NFE2L2MEN1KMT2APOLBCYP19A1
SCHEMBL7260787 0.78 MAPT (0.53) NFE2L2MEN1KMT2APOLBCYP19A1
SCHEMBL2126759 0.78 SNCA (0.50) NFE2L2CYP19A1FBP1APPMAPT
SCHEMBL3247450 0.78 NFE2L2 (0.63) NFE2L2CYP19A1ALDH1A1TLR9TRPA1
SCHEMBL2126765 0.78 SNCA (0.50) NFE2L2CYP19A1FBP1APPMAPT
SCHEMBL2112646 0.78 NFE2L2 (0.63) NFE2L2CYP19A1ALDH1A1TLR9TRPA1
SCHEMBL2845201 0.77 RELA (0.55) NFE2L2RELAAPPSNCATRPA1
SCHEMBL2845206 0.77 RELA (0.55) NFE2L2RELAAPPSNCATRPA1
SCHEMBL29074272 0.77 NFE2L2 (0.58) NFE2L2MEN1KMT2APOLBCYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1144135-B1 METHOD OF MAKING NON-LINEAR OPTICAL POLYMER BATTELLE MEMORIAL INSTITUTE (US) 2004-06-16 EP claimed
US-5677107-A PHOTOHARDENABLE FILM WITH PHOTORESPONSIVE AGENT; IRRADIATING SELECTIVE PORTIONS OF CROSS-SECTIONAL PATTERNS THAT ARE TO BE COLORED DIFFERENTLY SPECTRA GROUP LIMITED, INC. (US) 1997-10-14 US claimed
EP-0445202-A1 MATERIALS EXHIBITING LARGE NON LINEAR OPTICAL PROPERTIES. INTELLPROP CORP (PA) 1991-09-11 EP claimed
WO-1990006535-A1 MATERIALS EXHIBITING LARGE NON LINEAR OPTICAL PROPERTIES INTELLPROP CORPORATION (PA) 1990-06-14 WO claimed
EP-0348220-A2 Optical waveguides GEC-MARCONI LIMITED (GB) 1989-12-27 EP claimed
US-10207988-B2 Methods and compositions for treatment of cancer and autoimmune disease THE JACKSON LABORATORY (US) 2019-02-19 US disclosed
EP-2724156-B1 METHODS AND COMPOSITIONS FOR TREATMENT OF CANCER AND AUTOIMMUNE DISEASE JACKSON LAB (US) 2017-08-16 EP disclosed
EP-2724156-A1 METHODS AND COMPOSITIONS FOR TREATMENT OF CANCER AND AUTOIMMUNE DISEASE The Jackson Laboratory (US) 2014-04-30 EP disclosed
US-20130184342-A1 METHODS AND COMPOSITIONS FOR TREATMENT OF CANCER AND AUTOIMMUNE DISEASE THE JACKSON LABORATORY (US) 2013-07-18 US disclosed
EP-2276394-B1 VISION CORRECTING DEVICE TO TREAT AND PREVENT LOSS OF VISUAL ACUITY CRT TECHNOLOGY INC (US) 2013-07-17 EP disclosed
WO-2013003112-A1 METHODS AND COMPOSITIONS FOR TREATMENT OF CANCER AND AUTOIMMUNE DISEASE THE JACKSON LABORATORY (US) 2013-01-03 WO disclosed
US-7905595-B2 System and method to treat and prevent loss of visual acuity CRT TECHNOLOGY, INC. (US) 2011-03-15 US disclosed
US-5321084-A Benzimidazole-derivatized azo compounds and polymers derived therefrom for nonlinear optics MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1994-06-14 US disclosed
US-5097016-A Blending a polypeptide or polylactam and a nitro-containing urea, enone, aniline, heterocyclic, stilbene or merocyanine derivative; no secondary harmonic generation; easy phase matching NIPPON OIL CO., LTD. (JP) 1992-03-17 US disclosed
US-5011623-A Nonlinear optical material and nonlinear optical device CANON KABUSHIKI KAISHA (JP) 1991-04-30 US disclosed
EP-0406888-A2 Nonlinear optical polymer composition and method for producing the same SUMITOMO ELECTRIC INDUSTRIES, LTD. (JP) 1991-01-09 EP disclosed
US-4958895-A Optical waveguides GEC-MARCONI LIMITED (GB) 1990-09-25 US disclosed
EP-0351832-A2 Nonlinear optical material and nonlinear optical device CANON KABUSHIKI KAISHA (JP) 1990-01-24 EP disclosed
EP-0348220-A2 Optical waveguides GEC-MARCONI LIMITED (GB) 1989-12-27 EP disclosed
EP-0338702-A1 Nonlinear optical materials NIPPON OIL CO. LTD. (JP) 1989-10-25 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 (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-20130184342-A1 METHODS AND COMPOSITIONS FOR TREATMENT OF CANCER AND AUTOIMMUNE DISEASE BAK1, SSB, MRE11 NFE2L2 1261/4885MEN1 1722/4885KMT2A 2241/4885
US-10207988-B2 Methods and compositions for treatment of cancer and autoimmune disease BAK1, SSB, MRE11 NFE2L2 1261/4885MEN1 1722/4885KMT2A 2241/4885

“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.