SCHEMBL869872

SCHEMBL869872

C[N+]1(Cc2ccccc2)C=CN=C1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.33
HIF1A Q16665 1/20 0.32
CYP2D6 P10635 1/20 0.32
CALM1 P0DP23 1/20 0.31
ALDH1A1 P00352 1/20 0.30
TSHR P16473 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
Hydrochloric Acid SCHEMBL4053162 0.74 HIF1A (0.33) TP53HIF1ACALM1ALDH1A1TSHR
SCHEMBL9935822 0.69
Hydrochloric Acid SCHEMBL10684679 0.69 HIF1A (0.30) HIF1A
Phenethylamine SCHEMBL7037836 0.68 HTR2A (0.53) CYP2D6
SCHEMBL1045328 0.61 CYP2D6 (0.38) TP53HIF1ACYP2D6CALM1ALDH1A1
SCHEMBL9843821 0.60
SCHEMBL3681307 0.58 CHRNA7 (0.60) HIF1ACYP2D6ALDH1A1
SCHEMBL10256696 0.58 CHRNA7 (0.46) TP53HIF1ACYP2D6CALM1
SCHEMBL10256901 0.57 CHRNB2 (0.61) CYP2D6ALDH1A1
Iodide SCHEMBL3691022 0.57 CHRNA7 (0.63) CYP2D6ALDH1A1

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 17 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1999009845-A1 IMIDAZOQUINOXALINE PROTEIN TYROSINE KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 1999-03-04 WO claimed
US-11737345-B2 Organic electronic material, ink composition containing same, and organic thin film, organic electronic element, organic electroluminescent element, lighting device, and display device formed therewith RESONAC CORPORATION (JP) 2023-08-22 US disclosed
US-20210028366-A1 ORGANIC ELECTRONIC MATERIAL, INK COMPOSITION CONTAINING SAME, AND ORGANIC THIN FILM, ORGANIC ELECTRONIC ELEMENT, ORGANIC ELETROLUMINESCENT ELEMENT, LIGHTING DEVICE, AND DISPLAY DEVICE FORMED THEREWITH RESONAC CORPORATION (JP) 2021-01-28 US disclosed
US-10840451-B2 Organic electronic material, ink composition containing same, and organic thin film, organic electronic element, organic eletroluminescent element, lighting device, and display device formed therewith HITACHI CHEMICAL COMPANY, LTD. (JP) 2020-11-17 US disclosed
US-20180145257-A1 ORGANIC ELECTRONIC MATERIAL, INK COMPOSITION CONTAINING SAME, AND ORGANIC THIN FILM, ORGANIC ELECTRONIC ELEMENT, ORGANIC ELETROLUMINESCENT ELEMENT, LIGHTING DEVICE, AND DISPLAY DEVICE FORMED THEREWITH RESONAC CORPORATION (JP) 2018-05-24 US disclosed
US-9929346-B2 Organic electronic material, ink composition containing same, and organic thin film, organic electronic element, organic electroluminescent element, lighting device, and display device formed therewith HITACHI CHEMICAL COMPANY, LTD. (JP) 2018-03-27 US disclosed
US-9583714-B2 Material for organic electronics, organic electronic element, organic electroluminescent element, display element using organic electroluminescent element, illuminating device, and display device HITACHI CHEMICAL COMPANY, LTD. (JP) 2017-02-28 US disclosed
US-20150263288-A1 ORGANIC ELECTRONIC MATERIAL, INK COMPOSITION CONTAINING SAME, AND ORGANIC THIN FILM, ORGANIC ELECTRONIC ELEMENT, ORGANIC ELETROLUMINESCENT ELEMENT, LIGHTING DEVICE, AND DISPLAY DEVICE FORMED THEREWITH RESONAC CORPORATION (JP) 2015-09-17 US disclosed
EP-2485290-A1 MATERIAL FOR ORGANIC ELECTRONICS, ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, DISPLAY ELEMENT USING ORGANIC ELECTROLUMINESCENT ELEMENT, ILLUMINATING DEVICE, AND DISPLAY DEVICE Hitachi Chemical Company, Ltd. (JP) 2012-08-08 EP disclosed
US-20120181530-A1 MATERIAL FOR ORGANIC ELECTRONICS, ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, DISPLAY ELEMENT USING ORGANIC ELECTROLUMINESCENT ELEMENT, ILLUMINATING DEVICE, AND DISPLAY DEVICE RESONAC CORPORATION (JP) 2012-07-19 US disclosed
US-20120074360-A1 Organic Electronic Material, Ink Composition Containing Same, and Organic Thin Film, Organic Electronic Element, Organic Electroluminescent Element, Lighting Device, and Display Device Formed Therewith HITACHI CHEMICAL COMPANY (JP) 2012-03-29 US disclosed
US-7887920-B2 boron compounds such as tetrakis(pentafluorophenyl) borate used to improve durability, heat resistance and moisture resistance of light to heat conversion dyes, in optical filter for plasma displays or optical semiconductors NIPPON SHOKUBAI CO., LTD. (JP) 2011-02-15 US disclosed
EP-1846423-B1 BORATE AND NEAR-INFRARED RAY ABSORPTION MATERIAL NIPPON CATALYTIC CHEM IND (JP) 2010-12-08 EP disclosed
US-20080102279-A1 Borate and Near-Infrared Ray Absorption Material NIPPON SHOKUBAI CO., LTD. (JP) 2008-05-01 US disclosed
WO-2008026786-A1 SALT FOR NEAR INFRARED RAY ABSORBING COMPOSITION AND NEAR INFRARED RAY ABSORBING PRESSURE SENSITIVE ADHESIVE COMPOSITION NIPPON SHOKUBAI CO., LTD. (JP) 2008-03-06 WO disclosed
EP-1846423-A2 BORATE AND NEAR-INFRARED RAY ABSORPTION MATERIAL Nippon Shokubai Co.,Ltd. (JP) 2007-10-24 EP disclosed
WO-2006082945-A2 BORATE AND NEAR-INFRARED RAY ABSORPTION MATERIAL NIPPON SHOKUBAI CO., LTD. (JP) 2006-08-10 WO 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-20080102279-A1 Borate and Near-Infrared Ray Absorption Material BRD1, BRI3BP, BET1 TP53 3598/4885HIF1A 612/4885CYP2D6 2316/4885

“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.