SCHEMBL9970445

SCHEMBL9970445

[C-]#[N+]/C(C#N)=C1\CC(=O)c2ccccc21

nearest known ligand 0.31

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 1/20 0.31
BCHE P06276 1/20 0.31
CES1 P23141 1/20 0.31
ALDH1A1 P00352 2/20 0.30
KDM4E B2RXH2 1/20 0.30
HPGD P15428 1/20 0.30

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
SCHEMBL31607080 1.00 PIM1 (0.31) PIM1BCHECES1ALDH1A1KDM4E
SCHEMBL9970447 0.88
SCHEMBL10018093 0.88
SCHEMBL31571398 0.82 GAA (0.32) ALDH1A1
SCHEMBL31607079 0.82 GAA (0.32) ALDH1A1
SCHEMBL31571397 0.82 GAA (0.32) ALDH1A1
SCHEMBL11934060 0.81 ALDH1A1 (0.30) ALDH1A1
SCHEMBL806906 0.78 MAPT (0.38) PIM1BCHECES1ALDH1A1KDM4E
SCHEMBL29444282 0.78 MAPT (0.38) PIM1BCHECES1ALDH1A1KDM4E
SCHEMBL14600848 0.76 S100A4 (0.35) PIM1BCHECES1ALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230320212-A1 ORGANIC SEMICONDUCTOR MIXTURE AND ORGANIC OPTOELECTRONIC DEVICE CONTAINING THE SAME Raynergy Tek Incorporation (TW) 2023-10-05 US disclosed
US-20230227473-A1 TERNARY PHOTOACTIVE LAYER COMPOSITION AND ORGANIC SOLAR CELL COMPRISING SAME KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2023-07-20 US disclosed
US-11128791-B2 Photoelectric conversion element CANON KABUSHIKI KAISHA (JP) 2021-09-21 US disclosed
WO-2019215448-A1 POLYTHIOPHENE ELECTRON DONORS IN ORGANIC DEVICES IMPERIAL COLLEGE OF SCIENCE, TECHNOLOGY AND MEDICINE (GB) 2019-11-14 WO disclosed
US-9887370-B2 Compound for organic photoelectric device and organic photoelectric device image sensor, and electronic device including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2018-02-06 US disclosed
WO-2017191468-A1 NON-FULLERENE ELECTRON ACCEPTORS IMPERIAL INNOVATIONS LIMITED (GB) 2017-11-09 WO disclosed
WO-2017191466-A1 ORGANIC TERNARY BLENDS IMPERIAL INNOVATIONS LIMITED (GB) 2017-11-09 WO disclosed
US-20160181547-A1 COMPOUND FOR ORGANIC PHOTOELECTRIC DEVICE AND ORGANIC PHOTOELECTRIC DEVICE IMAGE SENSOR, AND ELECTRONIC DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2016-06-23 US disclosed
US-9368729-B2 Mixtures for producing photoactive layers for organic solar cells and organic photodetectors BASF SE (DE) 2016-06-14 US disclosed
US-20130170016-A1 PHOTOREFRACTIVE DEVICE CONTAINING A CHROMOPHORE-DOPED POLYMER LAYER AND ITS MANUFACTURING METHOD NITTO DENKO CORPORATION (JP) 2013-07-04 US disclosed
US-7985356-B2 Non-linear optical device sensitive to green laser NITTO DENKO CORPORATION (JP) 2011-07-26 US disclosed
US-7736548-B2 Non-linear optical device with long grating persistency NITTO DENKO CORPORATION (JP) 2010-06-15 US disclosed
US-20100099789-A1 METHOD FOR MODULATING LIGHT OF PHOTOREFRACTIVE COMPOSITION NITTO DENKO CORPORATION (JP) 2010-04-22 US disclosed
US-20100060975-A1 SYSTEMS AND METHODS FOR IMPROVING THE PERFORMANCE OF A PHOTOREFRACTIVE DEVICE NITTO DENKO CORPORATION (JP) 2010-03-11 US disclosed
US-20090197186-A1 OPTICAL DEVICES RESPONSIVE TO BLUE LASER AND METHOD OF MODULATING LIGHT NITTO DENKO CORPORATION (JP) 2009-08-06 US disclosed
US-20090052009-A1 NON-LINEAR OPTICAL DEVICE SENSITIVE TO GREEN LASER NITTO DENKO CORPORATION (JP) 2009-02-26 US disclosed
US-20080039603-A1 NON-LINEAR OPTICAL DEVICE WITH LONG GRATING PERSISTENCY NITTO DENKO CORPORATION (JP) 2008-02-14 US disclosed
US-7317058-B2 (Meth)acrylate polymer and non-linear optical device material composition NITTO DENKO CORPORATION (JP) 2008-01-08 US disclosed
US-7250121-B2 Non-linear optical device material composition NITTO DENKO CORPORATION (JP) 2007-07-31 US disclosed
US-7186781-B2 Fullerene-containing polymer, producing method thereof, and photorefractive composition NITTO DENKO CORPORATION (JP) 2007-03-06 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 (3 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-20230320212-A1 ORGANIC SEMICONDUCTOR MIXTURE AND ORGANIC OPTOELECTRONIC DEVICE CONTAINING THE SAME OSTC, NONO, OR10J3 PIM1 1388/4885BCHE 2770/4885CES1 4695/4885
US-20160181547-A1 COMPOUND FOR ORGANIC PHOTOELECTRIC DEVICE AND ORGANIC PHOTOELECTRIC DEVICE IMAGE SENSOR, AND ELECTRONIC DEVICE INCLUDING THE SAME PPOX, OCIAD1, PIEZO1 PIM1 429/4885BCHE 1619/4885CES1 332/4885
US-20230227473-A1 TERNARY PHOTOACTIVE LAYER COMPOSITION AND ORGANIC SOLAR CELL COMPRISING SAME CDH1, EPCAM, DSG1 PIM1 2052/4885BCHE 3772/4885CES1 4810/4885

“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.